𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Radical–molecule reaction CH2Cl + NO2: a mechanistic study

✍ Scribed by Jia-xu Zhang; Ze-sheng Li; Jing-yao Liu; Chia-chung Sun


Publisher
Springer
Year
2007
Tongue
English
Weight
248 KB
Volume
117
Category
Article
ISSN
1432-2234

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Theoretical mechanistic study on the rad
✍ Jia-Xu Zhang; Ze-Sheng Li; Jing-Yao Liu; Chia-Chung Sun 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 221 KB 👁 1 views

## Abstract The radical‐molecule reaction mechanism of CHCl~2~ and CCl~3~ with NO~2~ have been explored theoretically at the B3LYP/6‐311G(d,p) and MC‐QCISD (single‐point) levels. For the singlet potential energy surface (PES) of CHCl~2~ + NO~2~ reaction, the association of CHCl~2~ with NO~2~ was fo

Atmospheric chemistry of CH3Cl: mechanis
✍ Timothy J. Wallington; Michael D. Hurley; William F. Schneider 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 765 KB

Fourier transform infrared spectroscopy was used to identify CH2CIOOH and HC(O)CI as products of the gas phase reaction of CH2CIO 2 radicals with HO 2 radicals. At 700 Torr and 295 \_ 2 K, branching ratios of kla//kl = 0.27 \_+ 0.05 and klb/k ) ffi 0.73 \_+ 0.12 were obtained for the CH2CIOOH formin

Hydrogen abstraction reactions of OH rad
✍ Li Wang; Yanjie Li; Hongqing He; Jinglai Zhang 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 831 KB

The hydrogen abstraction reactions of OH radicals with CH₃CH₂CH₂Cl and CH₃CHClCH₃ (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

Rate constants for the gas-phase reactio
✍ Ole J. Nielsen; Howard W. Sidebottom; Denis J. O'Farrell; Michael Donlon; Jack T 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 514 KB

Rate constants for the reactions of OH radicals and Cl atoms with CH,CH,NO>, CH,CH,CH,NO,, CH3CH2CH2CHzN02, and CH,CH2CH2CH,CH2N02 have been determined at 295+3 K and a total pressure of approximately 1 atm. The OH rate data were obtained using both the absolute rate technique of pulse radiolysis co

Mechanistic study of the gas-phase react
✍ Timothy J. Wallington; Michael D. Hurley; William F. Schneider; Jens Sehested; O 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 781 KB

Fourier transform infrared spectroscopy was used to identify CH2FOOH and HC(O)F as products of the gas-phase reaction of CHIFOz radicals with HOs radicals. At 700 Torr and 295 + 2 K, branching ratios for the CHrFOOH forming channel, k,,/k, =0.29 f 0.08 and the HC(O)F channel, klb/kl =0.71 f 0.11 wer