Search results for "405"

showing 10 items of 3208 documents

Asymmetric synthesis of polycyclic 3-fluoroalkylproline derivatives by intramolecular azomethine ylide cycloaddition

2019

The asymmetric synthesis of polycyclic fluorinated proline derivatives has been accomplished by means of an intramolecular azomethine ylide cycloaddition with fluorinated dipolarophiles. Thus, the reaction of benzaldehydes bearing a trifluoromethyl alkene in ortho position with an azomethine ylide precursor derived from chiral 2-amino indanol takes place with excellent levels of diastereoselectivity, with simultaneous generation of four stereocenters. In order to determine the influence of the fluorine moiety in the process, starting material bearing non-fluorinated alkenes were synthesised. In this case, a dramatic drop of selectivity occurred, which indicates that the role of the fluorine…

chemistry.chemical_classificationTrifluoromethyl010405 organic chemistryAlkeneOrganic ChemistryEnantioselective synthesisSubstituentAzomethine ylide010402 general chemistry01 natural sciencesMedicinal chemistryCycloaddition0104 chemical sciencesStereocenterchemistry.chemical_compoundchemistryIntramolecular force
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Bridge-Clamp Bis(tetrazine)s with [N] 8 π-Stacking Interactions and Azido- s -Aryl Tetrazines: Two Classes of Doubly Clickable Tetrazines

2020

Click chemistry at a tetrazine core is useful for bioorthogonal labeling and crosslinking. Introduced here are two new classes of doubly clickable s-aryl tetrazines synthesized by Cu-catalyzed cross-coupling. Homocoupling of o-brominated s-aryl tetrazines leads to bis(tetrazine)s structurally characterized by tetrazine cores arranged face-to-face. [N]8 π-stacking interactions are essential to the conformation. Upon inverse electron demand Diels-Alder (iEDDA) cycloaddition, the bis(tetrazine)s produce a unique staple structure. The o-azidation of s-aryl tetrazines introduces a second proximal intermolecular clickable function that leads to double click chemistry opportunities. The stepwise i…

chemistry.chemical_classificationTrifluoromethylation010405 organic chemistryChemistryArylThio-General ChemistryGeneral Medicine010402 general chemistryCombinatorial chemistry01 natural sciencesBridge (interpersonal)CatalysisCycloaddition0104 chemical sciencesTetrazinechemistry.chemical_compoundPolymer chemistryClick chemistryNon-covalent interactions[CHIM]Chemical SciencesClickableBioorthogonal chemistry
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Gold(iii) tetraarylporphyrin amino acid derivatives: ligand or metal centred redox chemistry?

2015

EPR spectroscopy and DFT calculations show that the site of reduction of porphyrinato gold(iii) complexes depends on the counterions X, the meso substituents R and the solvent.

chemistry.chemical_classificationValence (chemistry)010405 organic chemistryGeneral Chemistry010402 general chemistryPhotochemistry01 natural sciencesPorphyrin0104 chemical scienceschemistry.chemical_compoundElectron transferChemistrychemistryValence isomerHexafluorophosphateDensity functional theoryElectron configurationCounterionChemical science
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Synthesis, characterization and magnetic properties of mixed-valence iron complexes with 2-pyridyl oximes

2018

Two new mixed-valence iron complexes with 2-pyridyl oximes, [Fe(mpko)3Fe(H2O)2(NO3)](NO3)·2H2O (1) (mpko− = methyl(2-pyridyl)ketone oximate) and [{Fe(dpko)3}2Fe](ClO4)·4H2O (2) (dpko− = bis(2-pyridyl)ketone oximate), have been prepared by reaction of FeIII with mpkoH in methanol (1) and FeII with dpkoH in methanol/water (2). Dinuclear FeII(low-spin)FeIII(high-spin) and trinuclear FeII(low-spin)FeIII(high-spin)FeII(low-spin) cations are present in the crystal structure of 1 and 2, respectively. Intermolecular hydrogen bonds in 1 lead to weak antiferromagnetic interactions between pairs of neighboring FeIII centers, which allows observation of single-ion zero-field splitting effects.

chemistry.chemical_classificationValence (chemistry)Ketone010405 organic chemistryChemistryHydrogen bondIntermolecular forceCrystal structure010402 general chemistry01 natural sciences0104 chemical sciencesMethyl 2-pyridyl ketone oximechemistry.chemical_compoundCrystallographyMaterials ChemistryAntiferromagnetismMethanolPhysical and Theoretical Chemistry
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Molecular magnetism, quo vadis? A historical perspective from a coordination chemist viewpoint☆

2017

Abstract Molecular magnetism has travelled a long way from the pioneering studies on electron exchange and double exchange or spin crossover and valence tautomerism in small oligonuclear complexes, from mono- to di- and tetranuclear species, to the current investigations about magnetic anisotropy and spin dynamics or quantum coherence of simple mono- or large polynuclear complexes, behaving as switchable bistable molecular nanomagnets for potential applications in information data storage and processing. In this review, we focus on the origin and development of the research in the field of molecular magnetism from a coordination chemistry viewpoint, which dates back to the establishment of …

chemistry.chemical_classificationValence (chemistry)Spintronics010405 organic chemistryMagnetismNanotechnology010402 general chemistry01 natural sciences0104 chemical sciencesCoordination complexInorganic ChemistrychemistrySpin crossoverMagnetochemistryMaterials ChemistryPhysical and Theoretical ChemistryQuantumQuantum computerCoordination Chemistry Reviews
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Oxotris(oxalato)niobate(V) as counterion in cobalt(II) spin-crossover systems

2016

Abstract This work is devoted to the investigation of the thermally induced spin-crossover behavior from a high-spin state (HS, S = 3/2) at higher temperatures to a low-spin phase (LS, S = 1/2) at lower temperatures of the six-coordinate cobalt(II) complex in the compound [Co(terpy)2]3[NbO(C2O4)3]2·3CH​3OH·4H2O (2). The crystal structure of 2 together with that of its counterion as tetraphenylarsonium(V) salt (AsPh4)3[NbO(C2O4)3]·9H2O (1) are also included. The spin-crossover process was followed by the thermal variation of the χMT product between 2.0 and 400 K under the warming mode, with the LS configuration being achieved at T ⩽ 200 K and the LS → HS interconversion being incomplete at 4…

chemistry.chemical_classificationZeeman effect010405 organic chemistryChemistryInorganic chemistrychemistry.chemical_elementCrystal structure010402 general chemistry01 natural sciences0104 chemical scienceslaw.inventionInorganic Chemistrysymbols.namesakelawSpin crossoverMaterials ChemistrysymbolsPhysical chemistryElectron configurationPhysical and Theoretical ChemistryCounterionElectron paramagnetic resonanceCobaltNatural bond orbitalPolyhedron
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Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones

2008

International audience; The [3 + 2] cycloaddition reaction between carbonyl ylides generated from epoxides and ketones (ethyl pyruvate, ethyl phenylglyoxylate, isatin, N-methylisatin and 5-chloroisatin) to give substituted dioxolanes and spirocyclic dioxolane indolinones was investigated. The effect of microwave irradiation on the outcome of the reaction was studied. The thermal reaction between 2,2-dicyano-3-phenyloxirane and N-methylisatin was theoretically studied using DFT methods. This reaction is a domino process that comprises two steps. The first is the thermal ring opening of the epoxide to yield a carbonyl ylide intermediate, whereas the second step is a polar [3 + 2] cycloadditio…

chemistry.chemical_classification[CHIM.ORGA]Chemical Sciences/Organic chemistry010405 organic chemistryOrganic ChemistryEpoxide010402 general chemistry01 natural sciencesBiochemistryCycloaddition0104 chemical scienceschemistry.chemical_compoundchemistryYlideDioxolaneYield (chemistry)ElectrophileOrganic chemistryStereoselectivityPhysical and Theoretical ChemistryChemoselectivityComputingMilieux_MISCELLANEOUSOrganic & Biomolecular Chemistry
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Functionalization of Bambusurils by a Thiol-Ene Click Reaction and a Facile Method for the Preparation of Anion-Free Bambus[6]urils

2018

Sulfide-functionalized bambus[4]urils ((RS)8 BU[4]) and bambus[6]urils ((RS)12 BU[6]) were synthesized through thiol-ene click coupling reactions (TEC) of allylbambus[n]urils. Thiosugars were grafted to BU[4] and BU[6]. Synthesis of BU[6] derivatives always requires the use of a template anion (iodide, chloride, or bromide), which is enclosed in the cavity of BU[6]. We show that this anion influences the reactivity of bambus[6]urils. An encapsulated iodide makes allyl functions of allyl12 BU[6] less reactive towards TEC and hydrogenation reactions in comparison to the corresponding chloride or bromide inclusion complexes. This is critical for the chemical reactivity of BU[6] and even more t…

chemistry.chemical_classification[CHIM.ORGA]Chemical Sciences/Organic chemistry010405 organic chemistryOrganic ChemistryIodideGeneral ChemistryNuclear magnetic resonance spectroscopy010402 general chemistry01 natural sciencesMedicinal chemistryQuantum chemistryCatalysisCoupling reaction0104 chemical sciences[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistrychemistry.chemical_compoundchemistryBromide[CHIM.CRIS]Chemical Sciences/CristallographyClick chemistryReactivity (chemistry)Ene reactionChemistry - A European Journal
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Guest-Induced Folding and Self-Assembly of Conformationally Adaptive Macrocycles into Nanosheets and Nanotubes

2017

A conformationally adaptive macrocycle is presented, namely zorb[4]arene, which exists in multiple conformations in the uncomplexed state. The binding cavity of zorb[4]arene is concealed, either due to a collapsed conformation or by self-inclusion. The zorb[4]arene with long alkyl chains manifests itself with surprisingly low melting point and thus exist as an oil at room temperature. Binding of a guest molecule induces the folding and conformational rigidity of zorb[4]arene and leads to well-defined three-dimensional structures, which can further self-assemble into nanosheets or nanotubes upon solvent evaporation, depending on guest molecules and the conformations they can induce.

chemistry.chemical_classificationadaptive macrocyclesnanosheets010405 organic chemistryStereochemistryOrganic ChemistryLow melting pointGeneral Chemistry010402 general chemistry01 natural sciencesCatalysissupramolecular chemistryguest-induced folding0104 chemical sciencesnanotubesFolding (chemistry)Solvent evaporationchemistryMoleculeSelf-assemblyta116AlkylChemistry: A European Journal
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Phytochemical constituents and chemosystematic significance of Pulicaria jaubertii E.Gamal-Eldin (Asteraceae)

2018

Abstract The chemical characterization of methylene chloride/methanol (1:1) extract of the air-dried whole medicinal plant, Pulicaria jaubertii E. Gamal-Eldin, led to isolation and identification of two new hydroquinone compounds; 2-(2-acetoxy propyl), 5-methyl hydroquinone (1) and 2-(2-hydroxy propyl), 5-methyl hydroquinone-4-O-β-D-glucopyranoside (2), four known flavonols (3-6) and 7 known dihydroflavonols (7-13). The structures were established depending upon comprehensive analysis of the NMR, IR and HR/EI-MS data. Herein, compounds 6, and 10-13 were isolated for the first time from this plant. The chemotaxonomic significance of the isolated flavonoids from P. jaubertii comparing with th…

chemistry.chemical_classificationbiologyHydroquinone010405 organic chemistryChemical structurePlant ScienceAsteraceaebiology.organism_classification01 natural sciencesBiochemistryPulicaria0104 chemical sciences010404 medicinal & biomolecular chemistrychemistry.chemical_compoundFlavonolschemistryPhytochemicalChemotaxonomyOrganic chemistryMethyleneAgronomy and Crop ScienceBiotechnologyPhytochemistry Letters
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