Exploring Pathways for Activation of Carbon Monoxide by Palladium Iminophosphines.

Chempluschem

Department of Chemistry, University of Bath, Claverton Down, Bath BA2 7AY (UK), Fax: (+44) 1225-386627.

Published: November 2013

DFT calculations on palladium(II) methyl complexes incorporating P/N ligands demonstrate that CO activation in the presence of competing ligands, such as CH CN or C H , occurs through an associative mechanism involving CO/ligand exchange, followed by migratory insertion of CO into the PdMe bond. Recent investigations into the Pd coordination of CO and C H and their subsequent insertion into the PdMe bonds of complexes of the type [PdMe(iminophosphine)(NCMe)] are reported.

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http://dx.doi.org/10.1002/cplu.201300214DOI Listing

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