0000000001071387

AUTHOR

Khai-nghi Truong

showing 173 related works from this author

Host–Guest Interactions of Sodiumsulfonatomethyleneresorcinarene and Quaternary Ammonium Halides: An Experimental–Computational Analysis of the Guest…

2020

The molecular recognition of nine quaternary alkyl- and aryl-ammonium halides (Bn) by two different receptors, Calkyl-tetrasodiumsulfonatomethyleneresorcinarene (An), were studied in solution using...

chemistry.chemical_classification010405 organic chemistryHalideGeneral Chemistry010402 general chemistryCondensed Matter Physics01 natural sciences0104 chemical scienceschemistry.chemical_compoundMolecular recognitionchemistryComputational chemistryGeneral Materials ScienceAmmoniumComputational analysisInclusion (mineral)AlkylCrystal Growth & Design
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5-Carbonyl-1,3-oxazine-2,4-diones from N-Cyanosulfoximines and Meldrum’s Acid Derivatives

2020

At elevated temperatures, N-cyanosulfoximines react with Meldrum's acid derivatives to give sulfoximines with N-bound 5-carbonyl-1,3-oxazine-2,4-dione groups. A representative product was characterized by single-crystal X-ray structure analysis. The product formation involves an unexpected molecular reorientation requiring several sequential bond-forming and -cleaving processes.

Structure analysis010405 organic chemistryOrganic Chemistry010402 general chemistryMeldrum's acid01 natural sciencesBiochemistry0104 chemical scienceschemistry.chemical_compoundchemistryProduct (mathematics)Organic chemistryProduct formationPhysical and Theoretical ChemistryOrganic Letters
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N-(2,3,5,6-Tetrafluoropyridyl)sulfoximines: synthesis, X-ray crystallography, and halogen bonding

2020

In the presence of KOH, NH-sulfoximines react with pentafluoropyridine to give N-(tetrafluoropyridyl)sulfoximines (NTFP-sulfoximines) in moderate to excellent yields. Either a solution-based or a superior solvent-free mechanochemical protocol can be followed. X-Ray diffraction analyses of 26 products provided insight into the bond parameters and conformational rigidity of the molecular scaffold. In solid-state structures, sulfoximines with halo substituents on the S-bound arene are intermolecularly linked by C–X⋯OS (X = Cl, Br) halogen bonds. Hirshfeld surface analysis is used to assess the type of non-covalent contacts present in molecules. For mixtures of three different S-pyridyl-substit…

1h nmr spectroscopyHalogen bond010405 organic chemistryChemistryOrganic Chemistrychemistry.chemical_element010402 general chemistry01 natural sciencesNitrogenOxygen0104 chemical sciencesCrystallographyHalogenX-ray crystallographyMoleculeOrganic Chemistry Frontiers
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The Difficult Marriage of Triarylcorroles with Zinc and Nickel Ions.

2022

The coordination chemistry of corrole has witnessed a great improvement in the past few years and its Periodic Table has been widened to be so large that it is compared with that of porphyrins. However, Ni and Zn ions, commonly used with porphyrins for both synthetic and theoretical purposes, are sparsely reported in the case of corroles. Here, we report synthetic protocols for preparing Ni and Zn triarylcorrole complexes. In the case of Zn, the preliminary oxidation of the free base corrole in DMSO to the neutral corrole radical is a necessary step to obtain the coordination of the metal ion, because the direct reaction led to the formation of an open-chain tetrapyrrole. The Ni complex cou…

Inorganic ChemistryIonskemiallinen synteesiaromaattiset yhdisteetZincsinkki (metallit)PorphyrinsNickelSettore CHIM/07Dimethyl SulfoxidekompleksiyhdisteetPhysical and Theoretical ChemistrynikkeliInorganic chemistry
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The C–I···–O–N+ Halogen Bonds with Tetraiodoethylene and Aromatic N-Oxides

2020

The nature of C–I⋯⁻O–N⁺ interactions, first of its kind, between non-fluorinated tetraiodoethylene XB-donor and pyridine N-oxides (PyNO) are studied by single-crystal X-ray diffraction (SCXRD) and ...

010405 organic chemistryChemistryTetraiodoethyleneGeneral Chemistry010402 general chemistryCondensed Matter Physics01 natural sciences0104 chemical sciences3. Good healthCrystallographychemistry.chemical_compoundHalogenPyridineGeneral Materials ScienceCrystal Growth & Design
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Supramolecular Chirogenesis in Bis-Porphyrin: Crystallographic Structure and CD Spectra for a Complex with a Chiral Guanidine Derivative

2021

The complexation of (3aR,7aR)-N-(3,5-bis(trifluoromethyl)phenyl)octahydro-2H-benzo[d]imidazol-2-imine (BTI), as a guest, to ethane-bridged bis(zinc octaethylporphyrin), bis(ZnOEP), as a host, has been studied by means of ultraviolet-visible (UV-Vis) and circular dichroism (CD) absorption spectroscopies, single crystal X-ray diffraction, and computational simulation. The formation of 1:2 host-guest complex was established by X-ray diffraction and UV-Vis titration studies. Two guest BTI molecules are located at the opposite sides of two porphyrin subunits of bis(ZnOEP) host, which is resting in the anti-conformation. The complexation of BTI molecules proceed via coordination of the imine nitr…

Circular dichroismPhysics and Astronomy (miscellaneous)General MathematicsImineSupramolecular chemistrychiralityCrystal structurehost-guest binding010402 general chemistryguanidine01 natural sciencesDFTsupramolecular chemistrykemialliset sidoksetchemistry.chemical_compoundsupramolekulaarinen kemiaComputer Science (miscellaneous)Molecule[CHIM]Chemical SciencesGuanidine010405 organic chemistrylcsh:Mathematicstiheysfunktionaaliteoriahost–guest bindinglcsh:QA1-939Porphyrin0104 chemical sciencescircular dichroismCrystallographyTD-DFT simulationchemistryChemistry (miscellaneous)Chirality (chemistry)porphyrin
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Regio- and Stereoselective Chloro Sulfoximidations of Terminal Aryl Alkynes Enabled by Copper Catalysis and Visible Light

2021

Advanced synthesis & catalysis 2552-2556 (2021). doi:10.1002/adsc.202100162

copper catalysisvinyl sulfoximine660StereochemistryAryldifunctionalizationchemistry.chemical_elementGeneral Chemistryalkyne additionCoppervisible-light photoredox catalysisCatalysischemistry.chemical_compoundTerminal (electronics)chemistryddc:660StereoselectivityVisible spectrum
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Studies of Nature of Uncommon Bifurcated I–I···(I–M) Metal-Involving Noncovalent Interaction in Palladium(II) and Platinum(II) Isocyanide Cocrystals

2021

Two isostructural trans-[MI2(CNXyl)2]·I2 (M = Pd or Pt; CNXyl = 2,6-dimethylphenyl isocyanide) metallopolymeric cocrystals containing uncommon bifurcated iodine···(metal–iodide) contact were obtained. In addition to classical halogen bonding, single-crystal X-ray diffraction analysis revealed a rare type of metal-involved stabilizing contact in both cocrystals. The nature of the noncovalent contact was studied computationally (via DFT, electrostatic surface potential, electron localization function, quantum theory of atoms in molecules, and noncovalent interactions plot methods). Studies confirmed that the I···I halogen bond is the strongest noncovalent interaction in the systems, followed …

chemistry.chemical_classificationplatinaHalogen bondhalogeenit010405 organic chemistryChemistryIsocyanideAtoms in moleculeskompleksiyhdisteet010402 general chemistrypalladium01 natural sciencesCocrystalElectron localization function0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographykemialliset sidoksetNucleophileNon-covalent interactionsPhysical and Theoretical ChemistryIsostructuralmetallit
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Room-Temperature Phosphorescence and Efficient Singlet Oxygen Production by Cyclometalated Pt(II) Complexes with Aromatic Alkynyl Ligands

2020

The synthesis of five novel cyclometalated platinum(II) compounds containing five different alkynyl-chromophores was achieved by the reaction of the previously synthesized Pt–Cl cyclometalated compound (1) with the corresponding RC≡CH by a Sonogashira reaction. It was observed that the spectral and photophysical characteristics of the cyclometalated platinum(II) complexes (Pt–Ar) are essentially associated with the platinum-cyclometalated unit. Room-temperature emission of the Pt–Ar complexes was attributed to phosphorescence in agreement with DFT calculations. Broad nanosecond (ns)-transient absorption spectra were observed with decays approximately identical to those obtained from the emi…

010405 organic chemistrySinglet oxygenPhosphorescenceluminesenssichemistry.chemical_elementkompleksiyhdisteetorganometalliyhdisteetOxigen010402 general chemistryLigands01 natural sciencesCombinatorial chemistry0104 chemical sciencesInorganic ChemistryOxygenchemistry.chemical_compoundhappiLligandschemistryFosforescènciaPhysical and Theoretical ChemistryPhysics::Chemical PhysicsPhosphorescencePlatinum
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The Preparation of Diaryl Sulfoxonium Triflates and Their Application in Palladium‐Catalyzed Cross‐Coupling Reactions

2022

Chemistry 17(19), e202200828 (2022). doi:10.1002/asia.202200828

sulfoxinium660Molecular StructuresulfoximinekemiaOrganic ChemistryGeneral ChemistryBiochemistryCatalysisonium salttriflateddc:660SaltsPalladiumcoupling reaction
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Thiourea Organocatalysts as Emerging Chiral Pollutants: En Route to Porphyrin-Based (Chir)Optical Sensing

2021

Environmental pollution with chiral organic compounds is an emerging problem requiring innovative sensing methods. Amino-functionalized thioureas, such as 2-(dimethylamino)cyclohexyl-(3,5-bis(trifluoromethyl)phenyl)thiourea (Takemoto’s catalyst), are widely used organocatalysts with virtually unknown environmental safety data. Ecotoxicity studies based on the Vibrio fischeri luminescence inhibition test reveal significant toxicity of Takemoto’s catalyst (EC50 = 7.9 mg/L) and its NH2-substituted analog (EC50 = 7.2–7.4 mg/L). The observed toxic effect was pronounced by the influence of the trifluoromethyl moiety. En route to the porphyrin-based chemosensing of Takemoto-type thioureas, their s…

Circular dichroismSupramolecular chemistrychiralitymonitorointiEnvironmental pollutionchiral amineVibrio fischeriQD415-436010402 general chemistryBiochemistry01 natural sciencesMedicinal chemistrysupramolecular chemistrybakteeritAnalytical Chemistry<i>Vibrio</i> <i>fischeri</i>chemistry.chemical_compoundkatalyytitrikkiyhdisteetsupramolekulaarinen kemiaMoiety[CHIM]Chemical Sciences[CHIM.COOR]Chemical Sciences/Coordination chemistryPhysical and Theoretical Chemistrythioureaorgaaniset yhdisteetchiral pollutantsTrifluoromethyl010405 organic chemistrytoxicityhost–guest bindingPorphyrin0104 chemical sciencesTakemoto’s catalystcircular dichroismekotoksikologiachemistryThiourea13. Climate action[SDV.TOX.ECO]Life Sciences [q-bio]/Toxicology/Ecotoxicology[SDE.BE]Environmental Sciences/Biodiversity and EcologyChirality (chemistry)porphyrinorganocatalyst
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Optimizing the SYBR green related cyanine dye structure to aim for brighter nucleic acid visualization

2022

In recent years, the studies of RNA and its use for the development of RNA based vaccines have increased drastically. Although cyanine dyes are commonly used probes for studying nucleic acids, in a wide range of applications, there is still a growing need for better and brighter dyes. To meet this demand, we have systematically studied the structure of SYBR green-related cyanine dyes to gain a deeper understanding of their interactions with biomolecules especially how they interact with nucleic acids and the structural components which makes them strongly fluorescent. Herein, five new dyes were synthesized, and their photophysical properties were evaluated. Observations of photophysical cha…

kemiallinen synteesiväriaineetProcess Chemistry and TechnologyGeneral Chemical Engineeringtiheysfunktionaaliteoriafluoresenssinukleiinihapotmolecular dockingcyanine dyeX-ray crystal structureDFT calculationstestausbiomolekyylitnucleic acidfluorescent probesyaniiniväriaineetröntgenkristallografiaDyes and Pigments
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A copper-catalyzed interrupted domino reaction for the synthesis of fused triazolyl benzothiadiazine-1-oxides

2023

Chemistry - a European journal 29(13), e202203729 (2023). doi:10.1002/chem.202203729

kemiallinen synteesikatalyysiddc:540Organic ChemistrykupariGeneral Chemistryheterosykliset yhdisteet540Catalysis
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A handy and accessible tool for identification of Sn(II) in toothpaste.

2021

AbstractAn easily accessible colorimetric probe, a carbazole–naphthaldehyde conjugate (CNP), was successfully prepared for the selective and sensitive recognition of Sn(II) in different commercially-available toothpaste and mouth wash samples. The binding mechanism of CNP for Sn2+ was confirmed by UV–Vis, 1H, and 13C NMR titrations. The proposed sensing mechanism was supported by quantum chemical calculations. Selective detection of Sn(II) in the nanomolar range (85 nM), among other interfering metal ions, makes it exclusive. Moreover, Sn2+ can be detected with a simple paper strip from toothpaste, which makes this method handy and easily accessible. The potential application of this system…

toothpasteMultidisciplinarykemialliset yhdisteetkemiaScienceenvironmental effectsQRchemistryympäristövaikutuksetterveysvaikutuksetMedicinetinahammastahnatfluoriditScientific reports
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Iron(III) Chloride as a Mild Catalyst for the Dearomatizing Cyclization of N-Acylindoles

2020

A catalytic approach for the preparation of indolines by dearomatizing cyclization is presented. FeCl3 acts as a catalyst to afford tetracyclic 5a,6-dihydro-12H-indolo[2,1-b][1,3]benzoxazin-12-ones in good yields. The cyclization also proceeds with tosylamides forming C-N bonds in 53% yield.

chemistry.chemical_compound010405 organic chemistryChemistryYield (chemistry)Organic Chemistry010402 general chemistry01 natural sciencesMedicinal chemistryIron(III) chloride0104 chemical sciencesCatalysisThe Journal of Organic Chemistry
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1,2‐Benzothiazine Derivatives from Sulfonimidamides by Metal‐Catalyzed Annulation Reactions in Solution and under Solvent‐Free Mechanochemical Condit…

2021

Advanced synthesis &amp; catalysis (2021). doi:10.1002/adsc.202001505 special issue: "Hot Topic: C-H Activation"

Annulationkemiallinen synteesiSolvent free660iridium catalysisChemistrysulfonimidamideGeneral ChemistryBenzothiazine12-benzothiazineC−H activationCatalysisMetalchemistry.chemical_compoundMechanochemistryvisual_artkatalyysirikkiyhdisteetddc:660visual_art.visual_art_mediumrhodium catalysisOrganic chemistrymechanochemistryorgaaniset yhdisteet
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2,3-Dihydro-1,2,6-thiadiazine 1-Oxides by Biginelli-Type Reactions with Sulfonimidamides under Mechanochemical Conditions.

2021

Biginelli-type multicomponent reactions (MCRs) with NH-free sulfonimidamides provide 2,3-dihydro-1,2,6-thiadiazine 1-oxides in high yields. The couplings are performed in a planetary ball mill under solvent-free mechanochemical conditions. Acetic acid or ytterbium triflate are used as catalysts. A representative product was characterized by X-ray single crystal structure analysis revealing molecular details of the highly functionalized three-dimensional heterocycle. Further product modifications lead to additional structural scaffolds.

YtterbiumStructure analysis010405 organic chemistryChemistryOrganic Chemistrychemistry.chemical_element010402 general chemistry01 natural sciencesBiochemistryCombinatorial chemistry0104 chemical sciencesCatalysisAcetic acidchemistry.chemical_compoundPhysical and Theoretical ChemistrySingle crystalBall millTrifluoromethanesulfonateOrganic letters
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Synthesis of trifluoromethyl-substituted 1,2,6-thiadiazine 1-oxides from sulfonimidamides under mechanochemical conditions

2021

TBS-protected or NH-sulfonimidamides react with β-alkoxyvinyl trifluoromethylketones under solvent-free mechanochemical conditions to give 3-trifluoromethyl-substituted three-dimensional 1,2,6-thiadiazine 1-oxides. C4-Functionalized products can be obtained by starting from cyclic enones and brominations of the initially formed heterocycles. The stability of the products was investigated by varying the pH value and storage under aerobic conditions.

chemistry.chemical_compoundTrifluoromethylChemistryOrganic ChemistryOrganic chemistryPhysical and Theoretical ChemistryBiochemistryValue (mathematics)Organic &amp; Biomolecular Chemistry
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Carbonyl Hypoiodites as Extremely Strong Halogen Bond Donors

2021

Abstract Neutral halogen‐bonded O−I−N complexes were prepared from in situ formed carbonyl hypoiodites and aromatic organic bases. The carbonyl hypoiodites have a strongly polarized iodine atom with larger σ‐holes than any known uncharged halogen bond donor. Modulating the Lewis basicity of the selected pyridine derivatives and carboxylates leads to halogen‐bonded complexes where the classical O−I⋅⋅⋅N halogen bond transforms more into a halogen‐bonded COO−⋅⋅⋅I−N+ ion‐pair (salt) with an asymmetric O−I−N moiety. X‐ray analyses, NMR studies, and calculations reveal the halogen bonding geometries of the carbonyl hypoiodite‐based O−I−N complexes, confirming that in the solid‐state the iodine at…

Halogen Bondingpyridineinorganic chemicalsHalogen bondOrganic basehalogeenitCommunicationSupramolecular chemistryGeneral ChemistryNuclear magnetic resonance spectroscopyGeneral MedicinehypoioditeMedicinal chemistryCatalysisCommunicationssupramolecular chemistrychemistry.chemical_compoundkemialliset sidoksetNMR spectroscopychemistryPyridineTrifluoroacetic acidsupramolekulaarinen kemiaMoietyCarboxylateAngewandte Chemie
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Fluorescence enhancement of quinolines by protonation.

2020

A study of the fluorescence enhancement of isoquinoline, acridine (benzo[b]quinoline) and benzo[h]quinoline is reported with six organic acids of different pKa values. Protonation was found to be an effective tool in the fluorescence enhancement of quinolines. A significant increase in the fluorescence intensity is observed only when strong acids are used, resulting in an over 50-fold increase in fluorescence with trifluoroacetic or benzenesulfonic acid and isoquinoline in a 1.5 : 1 ratio. The benzenesulfonic acid was found to be the most effective in the protonation of the bases despite its higher pKa value compared to trifluoro- and trichloroacetic acid. The X-ray crystal structures of 14…

aromaattiset yhdisteet010405 organic chemistryHydrogen bondprotonationGeneral Chemical Engineering116 Chemical sciencesQuinolinefluoresenssifluorescence enhancementProtonationGeneral Chemistry010402 general chemistry01 natural sciencesMedicinal chemistryFluorescence3. Good health0104 chemical scienceschemistry.chemical_compoundBenzenesulfonic acidchemistryAcridineTrichloroacetic acidIsoquinolineRSC advances
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Reliable fluorescence technique to detect the antibiotic colistin, a possible environmental threat due to its overuse.

2022

AbstractColistin, considered a drug of last resort as it is effective towards multidrug-resistant Gram-negative bacterial infections. Oral administration of colistin in the poultry industry is a common practice, not only to prevent and reduce bacterial infections, but also as a rapid-growth promoter. Long-term exposure to any antibiotic will eventually lead to the development of bacterial resistance towards all antibiotics through various mechanisms in the physiological system and environment. Chicken is the most consumed source of animal protein for humans throughout the world. In addition, the manure of poultry, containing traces of the used antibiotics, is being used in farming. Exposure…

MultidisciplinaryColistinfluoresenssiantibiootitBacterial InfectionsMicrobial Sensitivity Testsbiochemical phenomena metabolism and nutritionequipment and suppliesympäristökemiaFluorescenceAnti-Bacterial AgentsDrug Resistance Bacterialbacteriahaitalliset aineetAnimalsheterosykliset yhdisteetGram-Negative Bacterial InfectionsScientific reports
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Mechanochemical Syntheses of N-Containing Heterocycles with TosMIC

2021

A mechanochemical van Leusen pyrrole synthesis with a base leads to 3,4-disubstitued pyrroles in moderate to excellent yields. The developed protocol is compatible with a range of electron-withdrawing groups and can also be applied to the synthesis of oxazoles. Attempts to mechanochemically convert the resulting pyrroles into porphyrins proved to be difficult.

chemistry.chemical_compoundchemistryOrganic ChemistryTosMICCombinatorial chemistryPyrroleThe Journal of Organic Chemistry
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Gold(I)-doped films: new routes for efficient room temperature phosphorescent materials

2021

The synthesis of four novel gold(I)-phosphane complexes coordinated to 9-phenanthrene chromophore has been carried out through the reaction of 9-phenanthreneboronic acid and the corresponding AuClPR3 (PR3 = PPh3 for triphenylphosphane (1a); 1,4-bis(diphenylphosphanyl)butane or dppb (2b); bis(diphenylphosphanyl)acetylene or dppa (2c); (AuCl)2(diphos) (diphos = bis(diphenylphosphanyl)methane or dppm (3)) sources. The X-ray crystal structures of compounds 1a and 2b show the existence of MOF-like intermolecular assemblies that contain empty inner cavities in the absence of aurophilic contacts. In contrast, the formation of a tetranuclear complex with intramolecular aurophilic interactions was e…

LuminescenceLigandQuímica organometàl·licaLuminescènciaOrCrystal structureChromophoreFluorescenceInorganic Chemistrychemistry.chemical_compoundAcetylenechemistryOrganometallic chemistryIntramolecular forcePolymer chemistryGoldLuminescencePhosphorescence
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2-Sulfoximidoyl Acetic Acids from Multicomponent Petasis Reactions and Their Use as Building Blocks in Syntheses of Sulfoximine Benzodiazepine Analog…

2021

Upon application of a multicomponent Petasis reaction, a broad range of NH-sulfoximines and boronic acids react with glyoxalic acid to afford the corresponding 2-substituted acetic acids with N-bound sulfoximidoyl groups. The protocol features excellent yields under ambient, metal-free conditions and short reaction times. Furthermore, the applicability of 2-sulfoximidoyl acetic acids as building blocks for synthesizing sulfoximine-based benzodiazepine analogues was demonstrated.

BenzodiazepinePetasis reaction010405 organic chemistrymedicine.drug_classChemistryOrganic ChemistrymedicinePhysical and Theoretical Chemistry010402 general chemistry01 natural sciencesBiochemistryCombinatorial chemistry0104 chemical sciencesOrganic letters
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Iodine(I) and Silver(I) Complexes of Benzoimidazole and Pyridylcarbazole Derivatives

2021

The synthesis of iodine(I) complexes with either benzoimidazole or carbazole-derived sp 2 N -containing Lewis bases is described, as well as their corresponding silver(I) complexes. The addition of elemental iodine to the linear two-coordinate Ag(I) complexes produces iodine(I) complexes with a three-center four-electron (3c-4e) [N — I — N] + bond. The 1 H and 1 H- 15 N HMBC NMR studies unambiguously confirm the formation of the complexes in all cases via the [N — Ag — N] + → [N — I — N] + cation exchange, with the 15 N NMR chemical shift change between 94 to 111 ppm when compared to the free ligand. The single crystal X-ray crystallographic studies on four I + complexes revealed highly sym…

halogeenitLigandChemical shiftOrganic ChemistrySupramolecular chemistrychemistry.chemical_elementGeneral ChemistryNuclear magnetic resonance spectroscopyhalogen(I)kompleksiyhdisteetIodineCatalysissupramolecular chemistryNMRCrystallographykemialliset sidoksetchemistryX-ray crystallographysupramolekulaarinen kemiahalogen bondLewis acids and basesNMR-spektroskopiaSingle crystalröntgenkristallografiaX-ray crystallography
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[3+2]‐Cycloadditions of N ‐Cyano Sulfoximines with 1,3‐Dipoles

2020

Involving the cyano group of N‐cyano sulfoximines in [3+2]‐cycloaddition reactions with 1,3‐dipoles provides practical routes for the construction of 5‐membered heterocycles bearing sulfoximinoyl moieties. An ytterbium‐catalyzed cycloaddition utilizing hydrazonoyl chlorides was developed, as well as a reaction involving imidoyl chlorides proceeding without the aid of a catalyst. Following these protocols, a range of sulfoximines with N‐1,2,4‐triazolyl and N‐1,2,4‐oxadiazolyl substituents was prepared. peerReviewed

betaiinisulfoximinebioaktiiviset yhdisteetOrganic ChemistryTriazoleOxadiazoleCycloadditiontriazolechemistry.chemical_compoundDipolechemistryPolymer chemistrybetaine13-dipolePhysical and Theoretical Chemistry13-dipolecycloadditionoxadiazoleorgaaniset yhdisteetEuropean Journal of Organic Chemistry
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Cation-translocation based isomerism offers a tool for the expansion of compressed helicates.

2021

A series of compressed M[Li313Ti2] (M = Li, Na, K, Rb, Cs) and expanded helicates M4[13Ti2] has been obtained. The helicates Li3[M13Ti2] or M4[13Ti2] with M = Na+, K+, Rb+, or Cs+ adopt the expanded structure in solution. By crystallization the compressed structures M[Li313Ti2] (M = Na, Rb) are obtained. This represents an example of cation-translocation based isomerism.

Inorganic ChemistryCrystallographylawChemistryCrystallizationlaw.inventionDalton transactions (Cambridge, England : 2003)
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Three-Dimensional Heterocycles by 5-exo-dig Cyclizations of S-Methyl-N-ynonylsulfoximines

2021

Upon treatment with Cs2CO3, S-methyl-N-ynonylsulfoximines undergo 5-exo-dig cyclizations to give three-dimensional heterocycles. The reactions proceed at ambient temperature with a wide range of substrates affording the corresponding products in good to excellent yields.

Range (particle radiation)ChemistryDigOrganic ChemistryPhysical and Theoretical ChemistryBiochemistryMedicinal chemistryOrganic Letters
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Iron(III) chloride as mild catalyst for the dearomatizing cyclization of N-acylindoles

2020

A catalytic approach for the preparation of indolines by dearomatizing cyclization is presented. FeCl3 acts as a catalyst to afford tetracyclic 5a,6-dihydro-12H-indolo[2,1-b][1,3]benzoxazin-12-ones in good yields. The cyclization also proceeds with tosylamides forming C-N bonds in 53 % yield. peerReviewed

katalyytitkemialliset yhdisteetkatalyysiorgaaninen kemiaindoliini
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Halogen-Bonded [N–I–N]− Complexes with Symmetric or Asymmetric Three-Center–Four-Electron Bonds

2023

A series of LH[Z–I–Z] halogen(I) complexes, where Z = saccharinato or phthalimido anions and LH = pyridinium, pyrazinium, tetrabutyl (TBA)- or tetramethylammonium (TMA) cations, were prepared, structurally characterized, and discussed as complexes consisting of a [N–I–N]− anion with a three-center–four-electron (3c-4e) halogen bond, and a hydrogen-bonding (pyridinium or pyrazinium) or inert (TBA or TMA) cation. The symmetric [N–I–N]− anion, reminiscent of the triiodide [I–I–I]− anion, is found to be structurally equivalent to its cationic analogue [N–I–N]+ with N–I bond lengths of 2.26 Å. In contrast to the homoleptic [N–I–N]+ complexes, asymmetry of the N–I bond lengths (2.21 and 2.28 Å) w…

jodikemialliset sidoksethalogeenitkompleksiyhdisteet
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5-Carbonyl-1,3-oxazine-2,4-diones from N-Cyanosulfoximines and Meldrum’s Acid Derivatives

2020

At elevated temperatures, N-cyanosulfoximines react with Meldrum’s acid derivatives to give sulfoximines with N-bound 5-carbonyl-1,3-oxazine-2,4-dione groups. A representative product was characterized by single-crystal X-ray structure analysis. The product formation involves an unexpected molecular reorientation requiring several sequential bond-forming and -cleaving processes. peerReviewed

crystal structurekemiallinen synteesicyclizationaddition reactionskemialliset reaktiotreaction productsrikkiyhdisteetchemical reactionstyppiyhdisteetorgaaniset yhdisteet
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The C–I・・・⁻O–N⁺ Halogen Bonds with Tetraiodoethylene and Aromatic N-oxides

2020

The nature of C–I⋯⁻O–N⁺ interactions, first of its kind, between non-fluorinated tetraiodoethylene XB-donor and pyridine N-oxides (PyNO) are studied by single-crystal X-ray diffraction (SCXRD) and Density Functional Theory (DFT) calculations. Despite the non-fluorinated nature of the C2I4, the I⋯O halogen bond distances are similar to well-known perfluorohaloalkane/-arene donor-PyNO analogues. With C2I4, oxygens of the N-oxides adopt exclusively 2-XB-coordination in contrast to the versatile bonding modes observed with perfluorinated XB-donors. The C2I4 as the XB donor forms with PyNO’s one-dimensional chain polymer structures in which the C2I4⋯(μ-PyNO)2⋯C2I4 segments manifesting two bondin…

pyridinekemialliset sidoksettetraiodoethyleneHalogen bondhalogeenisidoksetN-oxidepyridine N-oxide
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N-(2,3,5,6-Tetrafluoropyridyl)sulfoximines : synthesis, X-ray crystallography, and halogen bonding

2020

In the presence of KOH, NH-sulfoximines react with pentafluoropyridine to give N-(tetrafluoropyridyl)sulfoximines (NTFP-sulfoximines) in moderate to excellent yields. Either a solution-based or a superior solvent-free mechanochemical protocol can be followed. X-Ray diffraction analyses of 26 products provided insight into the bond parameters and conformational rigidity of the molecular scaffold. In solid-state structures, sulfoximines with halo substituents on the S-bound arene are intermolecularly linked by C–X⋯O[double bond, length as m-dash]S (X = Cl, Br) halogen bonds. Hirshfeld surface analysis is used to assess the type of non-covalent contacts present in molecules. For mixtures of th…

kemiallinen synteesikemialliset sidoksetrikkiyhdisteettyppiyhdisteetorgaaniset yhdisteetröntgenkristallografia
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CCDC 2069302: Experimental Crystal Structure Determination

2021

Related Article: Renè Hommelsheim, Heliana Michaela Núñez Ponce, Khai-Nghi Truong, Kari Rissanen, Carsten Bolm|2021|Org.Lett.|23|3415|doi:10.1021/acs.orglett.1c00874

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates[(5-oxo-5H-5-dibenzo[bd]thiophen-5-ylidene)amino](phenyl)acetic acid monohydrate
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CCDC 2106005: Experimental Crystal Structure Determination

2021

Related Article: Essi Taipale, Marcel Siepmann, Khai-Nghi Truong, Kari Rissanen|2021|Chem.-Eur.J.|27|17412|doi:10.1002/chem.202103152

bis(1-methyl-1H-31-benzimidazol-3-yl)iodanium hexafluorophosphateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1992632: Experimental Crystal Structure Determination

2020

Related Article: Khai-Nghi Truong, J. Mikko Rautiainen, Kari Rissanen, Rakesh Puttreddy|2020|Cryst.Growth Des.|20|5330|doi:10.1021/acs.cgd.0c00560

Space GroupCrystallography1-oxo-3-phenylpyridine tetraiodoetheneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2054859: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal Systembis{[(26-dimethylphenyl)azanylidyne]methyl}-bis(iodo)-palladium iodineCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1977489: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters8-methyl-5a6-dihydro-12H-indolo[21-b][13]benzoxazin-12-oneExperimental 3D Coordinates
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CCDC 2106359: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(isoquinoline)-(trifluoromethanesulfonato)-silverExperimental 3D Coordinates
researchProduct

CCDC 2000976: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemIsoquinolinium trifluoroacetateCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2169530: Experimental Crystal Structure Determination

2023

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Space GroupCrystallography1-azido-2-(S-methanesulfonimidoyl)benzeneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027290: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System2356-tetrafluoro-4-{[methyl(oxo)(pyridin-2-yl)-lambda6-sulfanylidene]amino}pyridineCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2069303: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal System13-diphenyl-35-dihydro-4H-125-benzothiadiazepine-14-dioneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2068113: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates1-[(acetyloxy)-iodanyl]-4-(piperidin-1-yl)-1-pyridine
researchProduct

CCDC 2027281: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography4-{[(2-bromophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027279: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{[(2-chlorophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineExperimental 3D Coordinates
researchProduct

CCDC 2000985: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyBenzoquinolinium trifluoroacetateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2169531: Experimental Crystal Structure Determination

2023

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Space GroupCrystallography35-diphenyl-[123]triazolo[51-c][124]benzothiadiazin-5-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1966175: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyN-methylisoquinolinium hepta-sodium 281420-tetraethyl-46101216182224-octahydroxycalix[4]arene-5111723-tetrayltetrakis(methylenesulfonate) unknown solvate tetrahydrateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2031247: Experimental Crystal Structure Determination

2021

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bis(mu-bis(diphenylphosphino)methyl)-bis(phenanthren-9-yl)-tetra-gold unknown solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106012: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters1-ethyl-56-dimethyl-1H-benzimidazoleExperimental 3D Coordinates
researchProduct

CCDC 2194827: Experimental Crystal Structure Determination

2022

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4-[2-(dimethylamino)ethenyl]-2-(methylsulfanyl)-1-phenylquinolin-1-ium iodide monohydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027299: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates44'-{[S-benzene-N-(2356-tetrafluoropyridine-4-)sulfonimidoyl]methylene}bis(tetrafluoropyridine)
researchProduct

CCDC 2027288: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2356-tetrafluoro-4-{[methyl(4-methylphenyl)oxo-lambda6-sulfanylidene]amino}pyridineExperimental 3D Coordinates
researchProduct

CCDC 2106008: Experimental Crystal Structure Determination

2021

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bis(1-ethyl-1H-31-benzimidazol-3-yl)iodanium hexafluorophosphateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027300: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System4-[S-methane-N-(2356-tetrafluoropyridine-4-)sulfonimidoyl]-1lambda5-pyridine N-oxideCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027289: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2356-tetrafluoro-4-{[methyl(4-nitrophenyl)oxo-lambda6-sulfanylidene]amino}pyridineExperimental 3D Coordinates
researchProduct

CCDC 1992633: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatesbis(2-methyl-1-oxopyridine) tetraiodoethene
researchProduct

CCDC 2069786: Experimental Crystal Structure Determination

2021

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tri-lithium sodium tris(mu-33'-(118-dioxo-258111417-hexaoxaoctadecane-118-diyl)di[benzene-12-bis(olato)])-di-titanium(iv) NN-dimethylformamide solvate dihydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2080282: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal System9-[4-(pyridin-4-yl)phenyl]-9H-carbazoleCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2068107: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyacetoxy(4-(dimethylamino)pyridin-1-ium-1-yl)iodateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2109381: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal System4-bromo-1-(4-methylphenyl)-3-(trifluoromethyl)-12-dihydro-1lambda626-thiadiazin-1-oneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1992636: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal Systemtetrakis(24-dimethyl-1-oxopyridine) tris(tetraiodoethene)Crystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1966174: Experimental Crystal Structure Determination

2020

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N-methylpyridinium tri-sodium 281420-tetraethyl-46101216182224-octahydroxycalix[4]arene-5111723-tetrayltetrakis(methylenesulfonate) methanol unknown solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106021: Experimental Crystal Structure Determination

2021

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(acetonitrile)-bis{9-[4-(pyridin-4-yl)phenyl]-9H-carbazole}-silver hexafluorophosphateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1977492: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System13415b-tetrahydro-2H10H-[13]benzoxazino[23-k]carbazol-10-oneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106017: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal Systembis[9-(pyridin-4-yl)-9H-carbazole]-silver hexafluorophosphate acetone solvateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106015: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatesbis(isoquinoline)-silver hexafluorophosphate
researchProduct

CCDC 2000981: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyAcridinium benzenesulfonateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1977495: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[2-(2-hydroxy-5-methylphenyl)-23-dihydro-1H-indol-1-yl](phenyl)methanoneExperimental 3D Coordinates
researchProduct

CCDC 2000978: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersIsoquinolinium benzenesulfonate unknown solvateExperimental 3D Coordinates
researchProduct

CCDC 1977494: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography5-(4-methylbenzene-1-sulfonyl)-5a6-dihydroindolo[21-b]quinazolin-12(5H)-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2069304: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal System13-diphenyl-35-dihydro-4H-125-benzothiadiazepine-14-dioneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106020: Experimental Crystal Structure Determination

2021

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Space GroupCrystallography9-[1-(1-diiodan-1-yl)-1-pyridin-4-yl]-9H-carbazoleCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2000982: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemAcridinium dichloroacetate dichloroacetic acidCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1970146: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates[2-({[2-(dimethylamino)ethyl]imino}methyl)-5-fluorophenyl]-[(thiophen-3-yl)ethynyl]-platinum
researchProduct

CCDC 2000986: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersBenzoquinolinium trichloroacetateExperimental 3D Coordinates
researchProduct

CCDC 2194825: Experimental Crystal Structure Determination

2022

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2-{[2-(dimethylamino)-1-phenylquinolin-4(1H)-ylidene]methyl}-3-methyl-13-benzoxazol-3-ium chloride methanol unknown solvate hemihydrateExperimental 3D Coordinates
researchProduct

CCDC 2106013: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal Structurebis(1-ethyl-56-dimethyl-1H-benzimidazole)-silver hexafluoro-antimony acetonitrile solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027291: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography2356-tetrafluoro-4-{[methyl(oxo)(pyridin-3-yl)-lambda6-sulfanylidene]amino}pyridineCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2000983: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersAcridinium dibromoacetate dibromoacetic acidExperimental 3D Coordinates
researchProduct

CCDC 1977488: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography3-chloro-5a6-dihydro-12H-indolo[21-b][13]benzoxazin-12-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106022: Experimental Crystal Structure Determination

2021

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Space GroupCrystallography(acetonitrile)-{9-[4-(pyridin-4-yl)phenyl]-9H-carbazole}-silver(i) hexafluorophosphateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106016: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal Structuredi(isoquinolin-2-yl)iodanium tris(iodine) triiodideCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2081478: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters{N-[2-(amino)cyclohexyl]-N'-phenylthiourea}-[5101520-tetrakis(4-chlorophenyl)porphyrinato]-zinc(ii) dichloromethane solvateExperimental 3D Coordinates
researchProduct

CCDC 1992635: Experimental Crystal Structure Determination

2020

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bis(1-oxopyridine) tetraiodoetheneSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027295: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{[benzyl(oxo)phenyl-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineExperimental 3D Coordinates
researchProduct

CCDC 2110993: Experimental Crystal Structure Determination

2022

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters1-{[(9-ethyl-9H-carbazol-3-yl)iminio]methyl}naphthalen-2-olateExperimental 3D Coordinates
researchProduct

CCDC 1977487: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography2-methyl-5a6-dihydro-12H-indolo[21-b][13]benzoxazin-12-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027286: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System2356-tetrafluoro-4-{[(2-methoxyphenyl)(methyl)oxo-lambda6-sulfanylidene]amino}pyridineCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2123611: Experimental Crystal Structure Determination

2022

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates1-[({[5-(hydroxymethyl)furan-2-yl]methylidene}hydrazinylidene)methyl]naphthalen-2-ol
researchProduct

CCDC 2069787: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameterstri-lithium rubidium tris(mu-33'-(118-dioxo-258111417-hexaoxaoctadecane-118-diyl)di[benzene-12-bis(olato)])-di-titanium(iv) NN-dimethylformamide solvate dihydrateExperimental 3D Coordinates
researchProduct

CCDC 1992630: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal Systembis(1-oxo-2-phenylpyridine) tetraiodoetheneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2068111: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{1-[(benzoyloxy)-iodanyl]-1-pyridin-4-yl}morpholineExperimental 3D Coordinates
researchProduct

CCDC 2194823: Experimental Crystal Structure Determination

2022

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2-{[2-(dimethylamino)-1-phenylpyridin-4(1H)-ylidene]methyl}-3-methyl-13-benzoxazol-3-ium chloride dihydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2092466: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyN-[(4-methylbenzene-1-sulfonyl)methyl]formamideCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2027297: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{[cyclopropyl(oxo)phenyl-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineExperimental 3D Coordinates
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CCDC 2000980: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureAcridinium trichloroacetateCell ParametersExperimental 3D Coordinates
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CCDC 2106004: Experimental Crystal Structure Determination

2021

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bis(1-methyl-1H-31-benzimidazol-3-yl)iodanium hexafluorophosphateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2054860: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal Structurebis{N-(26-dimethylphenyl)cyano}-bis(iodo)-platinumCell ParametersExperimental 3D Coordinates
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CCDC 2027322: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{[cyclohexyl(methyl)oxo-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineExperimental 3D Coordinates
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CCDC 2027278: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography2356-tetrafluoro-4-{[(4-fluorophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}pyridineCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2106007: Experimental Crystal Structure Determination

2021

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Space GroupCrystallography(acetonitrile)-bis(1-ethyl-1H-benzimidazole)-silver hexafluorophosphateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2027296: Experimental Crystal Structure Determination

2020

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4-{[ethyl(oxo)phenyl-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2068110: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersNN-dimethyl-1-{[(trifluoroacetyl)oxy]-iodanyl}-1-pyridin-4-amineExperimental 3D Coordinates
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CCDC 2027285: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System2356-tetrafluoro-4-{[(2-methoxyphenyl)(methyl)oxo-lambda6-sulfanylidene]amino}pyridineCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2027298: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal Structure4-{[dimethyl(oxo)-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineCell ParametersExperimental 3D Coordinates
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CCDC 1970147: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[2-({[2-(dimethylamino)ethyl]imino}methyl)-5-fluorophenyl]-[(naphthalen-2-yl)ethynyl]-platinumExperimental 3D Coordinates
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CCDC 2027277: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters(R)-2356-tetrafluoro-4-{[methyl(oxo)phenyl-lambda6-sulfanylidene]amino}pyridineExperimental 3D Coordinates
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CCDC 2109331: Experimental Crystal Structure Determination

2021

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Space GroupCrystallography1-(4-methylphenyl)-3-(trifluoromethyl)-1lambda626-thiadiazin-1-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2000977: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatesisoquinolinium trichloroacetate
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CCDC 2027287: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System2356-tetrafluoro-4-{[(4-methoxyphenyl)(methyl)oxo-lambda6-sulfanylidene]amino}pyridineCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2000979: Experimental Crystal Structure Determination

2020

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CCDC 2027282: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-{[(3-bromophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineExperimental 3D Coordinates
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CCDC 1977491: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters5a-phenyl-5a6-dihydro-12H-indolo[21-b][13]benzoxazin-12-oneExperimental 3D Coordinates
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CCDC 2106018: Experimental Crystal Structure Determination

2021

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bis[9-(pyridin-4-yl)-9H-carbazole]-silver tetrafluoroborate monohydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1992631: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal Systembis(26-dimethyl-1-oxopyridine) tetraiodoetheneCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027280: Experimental Crystal Structure Determination

2020

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4-{[(4-chlorophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}-2356-tetrafluoropyridineSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106019: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters(acetonitrile)-bis[9-(pyridin-4-yl)-9H-carbazole]-silver hexafluoroantimonateExperimental 3D Coordinates
researchProduct

CCDC 1977486: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal System(2-hydroxyphenyl)(5-methyl-1H-indol-1-yl)methanoneCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2106009: Experimental Crystal Structure Determination

2021

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researchProduct

CCDC 2027294: Experimental Crystal Structure Determination

2020

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CCDC 2106362: Experimental Crystal Structure Determination

2021

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researchProduct

CCDC 2062891: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersethyl 3-(4-fluorophenyl)-5-methyl-1-(4-methylphenyl)-1-oxo-23-dihydro-1lambda626-thiadiazine-4-carboxylateExperimental 3D Coordinates
researchProduct

CCDC 2000984: Experimental Crystal Structure Determination

2020

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CCDC 2054861: Experimental Crystal Structure Determination

2021

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researchProduct

CCDC 1992634: Experimental Crystal Structure Determination

2020

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researchProduct

CCDC 2106361: Experimental Crystal Structure Determination

2021

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researchProduct

CCDC 2107284: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters4-benzylidene-1-phenyl-45-dihydro-3H-1lambda62-thiazole-13-dioneExperimental 3D Coordinates
researchProduct

CCDC 2027276: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal Structure2356-tetrafluoro-4-{[methyl(oxo)phenyl-lambda6-sulfanylidene]amino}pyridineCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106011: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters156-trimethyl-1H-benzimidazol-3-ium 156-trimethyl-1H-benzimidazole iodideExperimental 3D Coordinates
researchProduct

CCDC 1993374: Experimental Crystal Structure Determination

2020

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6-methyl-N-[methyl(oxo)phenylsulfanylidene]-24-dioxo-34-dihydro-2H-13-oxazine-5-carboxamideSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2080281: Experimental Crystal Structure Determination

2021

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Space GroupCrystallography9-(pyridin-4-yl)-9H-carbazoleCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1984075: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters5-{[methyl(oxo)phenyl-lambda6-sulfanylidene]amino}-3-phenyl-124-oxadiazoleExperimental 3D Coordinates
researchProduct

CCDC 2000989: Experimental Crystal Structure Determination

2020

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researchProduct

CCDC 1992637: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographybis(246-trimethyl-1-oxopyridine) tetraiodoetheneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2000987: Experimental Crystal Structure Determination

2020

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researchProduct

CCDC 2027284: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography2356-tetrafluoro-4-{[(4-iodophenyl)(methyl)oxo-lambda6-sulfanylidene]amino}pyridineCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2019745: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters(phenanthren-9-yl)-(triphenylphosphine)-gold(i)Experimental 3D Coordinates
researchProduct

CCDC 2194826: Experimental Crystal Structure Determination

2022

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2-{[2-(dimethylamino)-1-phenylquinolin-4(1H)-ylidene]methyl}-3-methyl-13-benzothiazol-3-ium tetrafluoroborateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2027292: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2356-tetrafluoro-4-{[methyl(oxo)(pyridin-4-yl)-lambda6-sulfanylidene]amino}pyridineExperimental 3D Coordinates
researchProduct

CCDC 1970145: Experimental Crystal Structure Determination

2020

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[2-({[2-(dimethylamino)ethyl]imino}methyl)-5-fluorophenyl]-[(4-fluorophenyl)ethynyl]-platinumSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106003: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameterstetrakis(1-methyl-1H-benzimidazole)-di-silver bis(hexafluorophosphate)Experimental 3D Coordinates
researchProduct

CCDC 2031248: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters{mu-butane-14-diylbis(diphenylphosphine)}-bis(phenanthren-9-yl)-di-goldExperimental 3D Coordinates
researchProduct

CCDC 2194501: Experimental Crystal Structure Determination

2022

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Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates5-[{5'-[(5-benzoyl-1H-pyrrol-2-yl)(phenyl)methylidene]-1H5'H-[22'-bipyrrol]-5-yl}(phenyl)methylidene]-15-dihydro-2H-pyrrol-2-one
researchProduct

CCDC 2169543: Experimental Crystal Structure Determination

2023

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters5-methyl-3-phenyl-[123]triazolo[51-c][124]benzothiadiazin-5-one dichloromethane solvateExperimental 3D Coordinates
researchProduct

CCDC 1966171: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographytetrakis(ammonium) 281420-tetraethyl-46101216182224-octahydroxycalix[4]arene-5111723-tetrayltetrakis(methylenesulfonate) methanol solvate sesquihydrateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1977490: Experimental Crystal Structure Determination

2020

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Space GroupCrystallography9-methyl-5a6-dihydro-12H-indolo[21-b][13]benzoxazin-12-oneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2169528: Experimental Crystal Structure Determination

2023

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters3-phenyl-5-(trifluoromethyl)-[123]triazolo[51-c][124]benzothiadiazin-5-oneExperimental 3D Coordinates
researchProduct

CCDC 1992638: Experimental Crystal Structure Determination

2020

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Space GroupCrystallographybis(4-methyl-1-oxopyridine) tetraiodoetheneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2068114: Experimental Crystal Structure Determination

2021

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4-(piperidin-1-yl)-1-{[(trifluoroacetyl)oxy]-iodanyl}-1-pyridineSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2106010: Experimental Crystal Structure Determination

2021

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Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(156-trimethyl-1H-benzimidazole)-silver hexafluorophosphateExperimental 3D Coordinates
researchProduct

CCDC 2106358: Experimental Crystal Structure Determination

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