A computational study of the methanolysis of palladium-acyl bonds.
Density functional calculations suggest that intermolecular attack of methanol may be important in the methanolysis of simple Pd-acyl systems and that the energetics of this process are strongly dependent on the metal coordination environment.
Donald
Steven M A
SM
School of Engineering and Physical Sciences, Heriot-Watt University, Edinburgh, UK EH14 4AS.
Macgregor
Stuart A
SA
Settels
Volker
V
Cole-Hamilton
David J
DJ
Eastham
Graham R
GR