Electronic Structure of Early Transition-Metal Carbonyls:  Gas-Phase Photoelectron Spectroscopy of (η5-C5H5)M(CO)4(M = V, Nb, Ta)

2000 ◽  
Vol 19 (10) ◽  
pp. 2012-2021 ◽  
Author(s):  
Dennis L. Lichtenberger ◽  
Hua-Jun Fan ◽  
Nadine E. Gruhn ◽  
Thomas E. Bitterwolf ◽  
Skip Gallagher
Keyword(s):  
Electronic Structure ◽  
Transition Metal ◽  
Gas Phase ◽  
Photoelectron Spectroscopy ◽  
Metal Carbonyls ◽  
Early Transition Metal ◽  
Transition Metal Carbonyls ◽  
Early Transition

Mechanistic investigations of CO-photoextrusion and oxidative addition reactions of early transition-metal carbonyls: (η5-C5H5)M(CO)4(M = V, Nb, Ta)

2016 ◽  
Vol 18 (24) ◽  
pp. 16396-16403 ◽  
Author(s):  
Shih-Hao Su ◽  
Ming-Der Su
Keyword(s):  
Transition Metal ◽  
Oxidative Addition ◽  
Addition Reactions ◽  
Metal Carbonyls ◽  
Early Transition Metal ◽  
Model Study ◽  
Transition Metal Carbonyls ◽  
Mechanistic Investigations ◽  
Group 5 ◽  
Early Transition

A model study of the photoactivation reactions of Si–H bonds in trimethylsilane by group 5 (η5-C5H5)M(CO)4(M = V, Nb and Ta;Rea-S0-M) complexes is undertaken using the M06-2X/Def2-SVPD level of theory.

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