An ab Initio MO Study on the Transformation of Acetylene to Vinylidene in the Coordination Sphere of Rhodium(I). The Intra- and Intermolecular Proton Transfer Mechanism
- 1 January 1997
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of the American Chemical Society
- Vol. 119 (2) , 360-366
- https://doi.org/10.1021/ja962732q
Abstract
No abstract availableKeywords
This publication has 48 references indexed in Scilit:
- Vinylidene transition-metal complexes. 24. Reactions of diynes with [RhCl(PiPr3)2]: unsaturated C4 and partly unsaturated C6 chains between two rhodium centersOrganometallics, 1993
- Vinylidene and the Hammond postulateJournal of the American Chemical Society, 1992
- Metal-hydride alkynyl .fwdarw. metal-vinylidene rearrangements occurring in both solid state and solution. Role of the 1-alkyne substituent in determining the relative stability of .pi.-alkyne, hydride alkynyl, and vinylidene forms at cobaltOrganometallics, 1991
- Vinylidene transition-metal complexes. Part 13. The reactivity of [IrH5(PPri3)2] and [IrH2Cl(PPri3)2] toward Alk-1-ynes: synthesis of four-, five- and six-co-ordinate iridium complexes containing alkynyl, vinyl and vinylidene ligandsJ. Chem. Soc., Dalton Trans., 1991
- A study of the singlet and triplet states of vinylidene by photoelectron spectroscopy of H2C=C−, D2C=C−, and HDC=C−. Vinylidene–acetylene isomerizationThe Journal of Chemical Physics, 1989
- Synthesis of hydrido-bis(acetylide) complexes of rhodium and the molecular structures of mer-trans-[Rh(PMe3)3(H)(CCPh)2] and mer-trans-[{Rh(dmpe)(H)(CCSiMe3)2}2(µ-dmpe)](dmpe = Me2PCH2CH2PMe2)Journal of the Chemical Society, Chemical Communications, 1989
- Ab initio MO study of the full catalytic cycle of olefin hydrogenation by the Wilkinson catalyst RhCl(PR3)3Journal of the American Chemical Society, 1988
- Photoassisted polymerization of terminal alkynes by W(CO)6 involving catalyst generation by an alkyne to vinylidene ligand rearrangementJournal of the American Chemical Society, 1985
- Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitalsThe Journal of Chemical Physics, 1985
- Synthesis of [C5H5Rh(PhCCH)P(iPr)3] and [C5H5Rh(CCHPh)P(iPr)3]: Mechanism of the Conversion of an Alkyne Ligand into a Vinylidene LigandAngewandte Chemie International Edition in English, 1983