| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394584 | Computational and Theoretical Chemistry | 2012 | 8 Pages |
Abstract
⺠Carbonylation mechanisms of EG with CO2 were investigated theoretically. ⺠Reaction pathways and the corresponding energy profiles were obtained. ⺠The intramolecular cyclic process was found to be the rate-determining step. ⺠The mechanism of carbonyl substitution is more favorable.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Jun Ma, Jinli Liu, Zhaofu Zhang, Buxing Han,