Search results for "Vent"

showing 10 items of 24974 documents

Supramolecular open-framework architectures based on dicarboxylate H-bond acceptors and polytopic cations with three/four N–H+donor units

2015

International audience; Supramolecular assemblages based on anionic H-acceptors and cationic H-donors have been envisioned to elaborate open frameworks maintained by ionic H-bonds. Combinations of di-anionic chloranilate (CA2-), oxalate (Ox2-), or terephthalate (BDC2-) and trisimidazolium or tetrapyridinium derivatives (three and four N-H+ donors, respectively) yielded five architectures of formulae [(H3TrIB)(CA)1.5[middle dot]2DMF[middle dot]2.5H2O] (1), [(H4Tetrapy)(CA)2[middle dot]3DMF] (2), [(H3TrIB)(HOx)(Ox)[middle dot]5H2O] (3), [(H4Tetrapy)(Ox)2[middle dot]5H2O] (4), and [(H4Tetrapy)(BDC)2(H2O)[middle dot]1DMF[middle dot]3H2O] (5) (with TrIB = 1,3,5-trisimidazolylbenzene and Tetrapy …

010405 organic chemistryChemistryStereochemistryHydrogen bondSupramolecular chemistryCationic polymerizationIonic bondingSorptionGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter Physics01 natural sciencesOxalate0104 chemical sciencesSolventchemistry.chemical_compoundCrystallography[CHIM.COOR]Chemical Sciences/Coordination chemistryGeneral Materials ScienceCrystEngComm
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Conformational Switching of Multi-Responsive Ferrocenyl-Phenol Conjugates

2016

Multifunctional conformational switches based on the ferrocenyl-salicylic acid amide motif with increasing additional complexity at the Fc moiety (R = COOMe, CONHEt, CONHFc; H-2–H-4; Fc = ferrocenyl) have been prepared and their preferred secondary structures in solution have been elucidated by NMR and IR spectroscopy in combination with conformational searches based on DFT calculations. Their distinct conformational responses to deprotonation ([2]––[4]–) and oxidation ([H-2]+·–[H-4]+·) have been revealed by IR, EPR, and UV/Vis spectroscopy as well as by DFT calculations. Deprotonation inverts all amide units (double amide twist) whereas oxidation selectively flips the terminal amide unit (…

010405 organic chemistryChemistryStereochemistryOrganic ChemistryInfrared spectroscopy010402 general chemistry01 natural sciences0104 chemical scienceslaw.inventionchemistry.chemical_compoundDeprotonationlawAmideMoietyPhenolPhenolsPhysical and Theoretical ChemistryElectron paramagnetic resonanceSpectroscopyEuropean Journal of Organic Chemistry
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Diferratricarbaboranes of thesubcloso-[(η5-C5H5)2Fe2C3B8H11] Type, the First Representatives of the 13-Vertex Dimetallatricarbaborane Series

2003

Treatment of the [2-Cp-9-tBuNH-closo-2,1,7,9-FeC 3 B 8 H 1 0 ] (1) ferratricarbollide (Cp = η 5 -C 5 H 5 -) with Na + C 1 0 H 8 - in 1,2-dimethoxyethane (DME) at room temperature produced an air-sensitive transient anion with a tentatively identified nido-[tBUNH-CpFeC 3 B 8 H 1 0 ] 2 - constitution. In-situ reaction of this low-stability ion with [CpFe(CO) 2 I] or [CpFe(CO) 2 ] 2 generated three violet diferratricarbaboranes identified as paramagnetic subcloso complexes [4,5-Cp 2 - -4,5,1,6,7-Fe 2 C 3 B 8 H 1 1 ] (2; yield 2%), [4,5-Cp 2 - -4,5,1,7,12-Fe 2 C 3 B 8 H 1 1 ] (3; yield 2%), and [7-tBuNH-4,5-Cp 2 - -4,5,1,7,12-Fe 2 C 3 B 8 H 1 0 ] (4; yield 14%). These first representatives of t…

010405 organic chemistryChemistryStereochemistryOrganic ChemistryInfrared spectroscopyBoranesGeneral Chemistry010402 general chemistryMass spectrometry01 natural sciencesCatalysis3. Good health0104 chemical sciencesIonlaw.inventionVertex (geometry)CrystallographyParamagnetismlawYield (chemistry)Electron paramagnetic resonanceChemistry - A European Journal
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Aza and cyanobridged tripodal dinuclear copper(II) complexes: Electrochemical studies and structural evidence for an original azacyanocarbanion

2014

International audience; The reactivity of the mononuclear [Cu(TMPA)(L)] n+ complex (TMPA: tris(2-methylpyridine) amine, L: CH3CN, H2O) towards two different bridging species (tetracyanoethylene, 4,40-bipyridine) was investigated. The dinuclear complex [(mu-4,40-bipy)Cu-II(TMPA)(2)](CF3SO3)(4) (1) was synthesised and analysed by Xray diffraction (XRD). Magnetic studies revealed that this derivative displays very weak antiferromagnetic interactions between the two metal centres (2J = -0.69 cm(-1)). Solution studies (EPR spectroscopy and voltammetry) evidenced the lability of the bridged neutral bipyridine ligand in acetonitrile. The reaction of TCNE (TCNE: tetracyanoethylene) with the copper(…

010405 organic chemistryChemistryStereochemistrychemistry.chemical_elementCrystal structureTetracyanoethylene010402 general chemistryElectrochemistry01 natural sciencesCopper0104 chemical scienceslaw.inventionInorganic Chemistrychemistry.chemical_compoundCrystallographyBipyridinelaw[CHIM.ANAL]Chemical Sciences/Analytical chemistryMaterials ChemistryAmine gas treating[CHIM.COOR]Chemical Sciences/Coordination chemistryPhysical and Theoretical ChemistryElectron paramagnetic resonanceAcetonitrile
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Synthesis, molecular structures and EPR spectra of the paramagnetic cuboidal clusters with Mo3S4Ga cores

2017

Electron precise [Mo3(l3-S)(l-S)3(diphos)3Br3]Br (diphos = dppe, dmpe) incomplete cuboidal clusters with six cluster skeletal electrons (CSE) were converted into paramagnetic cuboidal [Mo3(GaBr)(l3-S)4- (diphos)3Br3] clusters by treatment with elemental Ga. The new heterobimetallic complexes with nine CSE possess a doublet ground state with the unpaired electron density delocalized over the three molybdenum atoms.

010405 organic chemistryChemistrychemistry.chemical_elementGeneral Chemistry010402 general chemistry01 natural sciencesCatalysisSpectral line0104 chemical scienceslaw.inventionDelocalized electronParamagnetismCrystallographyUnpaired electronlawComputational chemistryMolybdenumMaterials ChemistryCluster (physics)Ground stateElectron paramagnetic resonance
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Cis- and trans molybdenum oxo complexes of a prochiral tetradentate aminophenolate ligand : Synthesis, characterization and oxotransfer activity

2020

Abstract Reaction of [MoO2Cl2(dmso)2] with the tetradentate O2N2 donor ligand papy [H2papy = N-(2-hydroxybenzyl)-N-(2-picolyl)glycine] leads to formation of the dioxomolybdenum(VI) complex [MoO2(papy)] (1) as a mixture of cis and trans isomers. Recrystallization from methanol furnishes solid cis-1, whereas the use of a dichloromethane-hexane mixture allows for the isolation of the trans-1 isomer. Both isomers have been structurally characterized by X-ray crystallography and the energy difference between the isomeric pair has been investigated by electronic structure calculations. Optimization of two configurational isomers in the gas phase predicts the trans isomer to lie 2.5 kcal/mol lower…

010405 organic chemistryChemistrycomputational modellingStereoisomerism010402 general chemistry01 natural sciencesMedicinal chemistry0104 chemical sciencesCatalysisInorganic ChemistrySolventvariable temperature NMRTripodal ligandepoxidationMaterials ChemistryTheoretical chemistryProton NMRtripodal ligandPhysical and Theoretical ChemistryIsomerizationOxo Atom TransferCis–trans isomerism
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2-Methyltetrahydrofuran: A Green Solvent for Iron-Catalyzed Cross-Coupling Reactions

2018

Iron‐catalyzed cross‐coupling reactions allow sustainable formation of C−C bonds using cost‐effective, earth‐abundant base‐metal catalysis for complex syntheses of pharmaceuticals, natural products, and fine chemicals. The major challenge to maintain full sustainability of the process is the identification of green and renewable solvents that can be harnessed to replace the conventional solvents for this highly attractive reaction. Herein, iron‐catalyzed cross‐coupling of aryl chlorides and tosylates with challenging organometallic reagents possessing β‐hydrogens is found to proceed in good to excellent yields with the green, sustainable, and eco‐friendly 2‐methyltetrahydrofuran (2‐MeTHF) a…

010405 organic chemistryGeneral Chemical EngineeringAryl2-MethyltetrahydrofuranHomogeneous catalysis010402 general chemistry01 natural sciencesCombinatorial chemistryCoupling reaction0104 chemical sciencesCatalysisSolventchemistry.chemical_compoundGeneral EnergychemistryReagentFunctional groupEnvironmental ChemistryGeneral Materials ScienceChemSusChem
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Hydrogen-Bonded Open-Framework with Pyridyl-Decorated Channels: Straightforward Preparation and Insight into Its Affinity for Acidic Molecules in Sol…

2017

International audience; An hydrogen-bonded open framework with pores decorated by pyridyl groups has been constructed following an off-charge-stoichiometry assemblage of protonated tetrakis(4-pyridyl-oxymethyl)methane and [Al(oxalate)3]3-, respectively the H-bond donor and acceptor of the ionic H-bond interactions. This supramolecular porous architecture (SPA-2) possesses 1 nm-large pores interconnected in 3D with high solvent accessible void (53%). It demonstrated remarkable affinity for acidic organic molecules in solution, which was investigated by the means of various carboxylic acids including larger drug molecules. Noteworthy, competing sorption between acetic acid and its halogenated…

010405 organic chemistryHydrogen bondChemistryOrganic ChemistrySupramolecular chemistryIonic bondingProtonationSorptionGeneral ChemistryHydrogen-Bonding010402 general chemistry[ CHIM ] Chemical Sciences01 natural sciencessupramolecular chemistryCatalysis0104 chemical sciencesSolventPolymer chemistryhost-guest chemistry[CHIM]Chemical SciencesMoleculeOrganic chemistryoxalate complexporous materialHost–guest chemistryChemistry (Weinheim an der Bergstrasse, Germany)
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Cooperative H-bonds, π⋯π and anion⋯π interactions as driving forces in the construction of novel Cu(II) bis(imidazol-2-yl) supramolecular 3D framewor…

2019

Abstract Two new Cu(II) complexes with bis(2-imidazolyl) based ligands, with the formula [Cu(BIM)2(SCN)2]·2H2O (BIM = bis(2-imidazol-2-yl)methane) and [Cu(HBIMAM)2(OH2)2](BF4)4·2H2O (BIMAM = bis(2-imidazol-2-yl)methylaminomethane) have been synthesized and characterized. Both compounds contain mononuclear entities as molecular building blocks (MBBs); neutral [Cu(BIM)2(SCN)2] in compound 1 and cationic [Cu(HBIMAM)2(OH2)2]4+ in compound 2. The coordination around the metal atoms shows a tetragonally-elongated octahedral geometry (CuN4S2 and CuN4O2 chromophores). The Q-band EPR spectra of both compounds are indicative of an essentially d x 2 - y 2 ground state for copper(II) ions. The analysis…

010405 organic chemistryHydrogen bondChemistrySupramolecular chemistryCrystal structureChromophore010402 general chemistry01 natural sciences0104 chemical scienceslaw.inventionInorganic ChemistryMetalCrystallographylawvisual_artOctahedral molecular geometryMaterials Chemistryvisual_art.visual_art_mediumPhysical and Theoretical ChemistryGround stateElectron paramagnetic resonancePolyhedron
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Synthesis, Structural and Spectroscopic Characterization of Cr III , Fe III , Co III , Ni II and Cu II Complexes with an Asymmetric 1,3,4‐Thiadiazole…

2016

The reaction of the new asymmetric 1,3,4-thiadiazole-based ligand 2-[(5-ethylthio-1,3,4-thiadiazol-2-yl)hydrazonomethyl]phenol (H1ETHP) with various third-row transition metal salts resulted in the formation of six new mononuclear complexes [Cr(ETHP)2]ClO4 (1), [Fe(ETHP)2][FeCl4] (2), [Co(ETHP)(ETHP–H)] (3), [Ni(ETHP)(H1ETHP)]Cl (4), [Ni(ETHP)(H1ETHP)](ClO4) (5), [Ni(ETHP)(H1ETHP)]Br (6), and one tetranuclear complex [Cu2Cl3(ETHP)(H1ETHP)]2 (7). H1ETHP and all complexes have been analyzed by single crystal X-ray diffraction. Structural analysis of 1–6 reveals complexes of the [ML2]n+-type (n = 0,1), in which the mono anionic ligand ETHP coordinates in a tridentate NNO fashion via its imine,…

010405 organic chemistryHydrogen bondLigandStereochemistryImineSupramolecular chemistry010402 general chemistry01 natural sciences0104 chemical scienceslaw.inventionInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryTransition metalTetramerlawMoleculeElectron paramagnetic resonanceEuropean Journal of Inorganic Chemistry
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