Search results for "TUNGSTEN"

showing 2 items of 372 documents

An experimental and theoretical study of a heptacoordinated tungsten(VI) complex of a noninnocent phenylenediamine bis(phenolate) ligand

2018

Abstract [W(N2O2)(HN2O2)] (H4N2O2 = N,N′-bis(3,5-di-tert-butyl-2-hydroxyphenyl)-1,2-phenylenediamine) with a noninnocent ligand was formed by reaction of the alkoxide precursor [W(eg)3] (eg = the 1,2-ethanediolate dianion) with two equivalents of ligand. The phenol groups on one of the ligands are completely deprotonated and the ligand coordinates in a tetradentate fashion, whereas the other ligand is tridentate with one phenol having an intact OH group. The molecular structure, magnetic measurements, EPR spectroscopy, and density functional theory calculations indicate that the complex is a stable radical with the odd electron situated on the tridentate amidophenoxide ligand. The formal ox…

tungstenDFT calculations010402 general chemistry01 natural scienceslaw.inventionInorganic Chemistrychemistry.chemical_compoundDeprotonationlawOxidation stateMaterials ChemistryMoleculePhysical and Theoretical ChemistryElectron paramagnetic resonanceta116amidophenoxide radical010405 organic chemistryLigandkompleksiyhdisteetvolframielectronic structure0104 chemical sciencesCrystallographyoxidation statesUnpaired electronchemistryAlkoxidenoninnocent ligandDensity functional theoryInorganic Chemistry Communications
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On the mechanism of imine elimination from Fischer tungsten carbene complexes

2016

(Aminoferrocenyl)(ferrocenyl)carbene(pentacarbonyl)tungsten(0) (CO)5W=C(NHFc)Fc (W(CO)5(E-2)) is synthesized by nucleophilic substitution of the ethoxy group of (CO)5W=C(OEt)Fc (M(CO)5(1Et)) by ferrocenyl amide Fc-NH– (Fc = ferrocenyl). W(CO)5(E-2) thermally and photochemically eliminates bulky E-1,2-diferrocenylimine (E-3) via a formal 1,2-H shift from the N to the carbene C atom. Kinetic and mechanistic studies to the formation of imine E-3 are performed by NMR, IR and UV–vis spectroscopy and liquid injection field desorption ionization (LIFDI) mass spectrometry as well as by trapping experiments for low-coordinate tungsten complexes with triphenylphosphane. W(CO)5(E-2) decays thermally i…

tungstenIminemechanism010402 general chemistryPhotochemistry01 natural sciencesMedicinal chemistryReductive eliminationFull Research Paperlcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryAmideNucleophilic substitutionlcsh:Science010405 organic chemistryChemistryOrganic ChemistryferroceneOxidative addition0104 chemical sciencesChemistrycarbene complexesAlkoxy groupPseudorotationlcsh:QimineCarbeneBeilstein Journal of Organic Chemistry
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