Kinetics of the reaction between OH radicals and monochlorodimethylsulphide (CH3SCH2Cl)
β Scribed by Dudley E. Shallcross; Stewart Vaughan; David R. Trease; Carlos E. Canosa-Mas; Mariana V. Ghosh; John M. Dyke; Richard P. Wayne
- Book ID
- 113477177
- Publisher
- Elsevier Science
- Year
- 2006
- Tongue
- English
- Weight
- 211 KB
- Volume
- 40
- Category
- Article
- ISSN
- 1352-2310
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
The hydrogen abstraction reactions of OH radicals with CHβCHβCHβCl and CHβCHClCHβ (R2) have been investigated theoretically by a dual-level direct dynamics method. The optimized geometries and frequencies of the stationary points are calculated at the B3LYP/6-311G(d,p) level. To improve the reaction
Ab initio calculations at the [QCISD(T)/6-31 +G(Zdf, p)]//MP2/6-31G(d) level have been applied to CH$CH200, a radical which is thought to be important in the atmospheric oxidation of dimethylsulfide. The geometries of CH3SCH200 and the related CI-ISSCH20 radical are similar to other organic radicals