| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394229 | Computational and Theoretical Chemistry | 2013 | 10 Pages |
Abstract
⺠The reaction mechanism of CHF2 with NO2 is explored at the DFT, ab initio levels. ⺠The H-migration channel leading to P1 (CF2 + HONO) is the most favorable pathway. ⺠The reaction rates of CH3ânFn + NO2 (n = 1, 2 and 3) are compared. ⺠The title reaction can be an effective method of NO2-reduction in atmospheric chemistry.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Hai-long Liang, Guang-hui Chen, Feng-long Gu,