Prabha Vadivelu; Suresh, C H
(American Chemical Society, 2015)
The CO2 insertion reactions of [L4Ru(eta(2)-CH2C6H4)] (1), [L4Ru(eta(2)-OC6H3Me)] (2), and [L4Ru(eta(2)-NHC6H4)] (3), where L = PH3 and PMe3, are modeled using density functional theory methods. In 1 and 2, the metal-assisted ...