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Competing mechanisms in the carbonylation of neutral palladium(II) complexes containing bidentate ligands: theoretical insights

Citation

Frankcombe, KE and Cavell, KJ and Knott, RB and Yates, BF, Competing mechanisms in the carbonylation of neutral palladium(II) complexes containing bidentate ligands: theoretical insights, Chemical Communications, (6) pp. 781-782. ISSN 1359-7345 (1996) [Refereed Article]

DOI: doi:10.1039/cc9960000781

Abstract

Correlated ab initio calculations identify the rate-determining step in the carbonylation reaction of palladium(II) complexes of mixed bidentate anionic ligands, and supply new evidence for the participation of five-coordinate intermediates and transition structures.

Item Details

Item Type:Refereed Article
Research Division:Chemical Sciences
Research Group:Theoretical and computational chemistry
Research Field:Theoretical and computational chemistry not elsewhere classified
Objective Division:Expanding Knowledge
Objective Group:Expanding knowledge
Objective Field:Expanding knowledge in the chemical sciences
UTAS Author:Frankcombe, KE (Ms Katrina Ellen Frankcombe)
UTAS Author:Cavell, KJ (Professor Kingsley Cavell)
UTAS Author:Yates, BF (Professor Brian Yates)
ID Code:8398
Year Published:1996
Web of Science® Times Cited:11
Deposited By:Chemistry
Deposited On:1996-08-01
Last Modified:2011-08-19
Downloads:0

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