𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Theoretical study of the hydroformylation reaction mechanism

✍ Scribed by J.Ph. Grima; F. Choplin; G. Kauffmann

Book ID
108354081
Publisher
Elsevier Science
Year
1977
Tongue
English
Weight
963 KB
Volume
129
Category
Article
ISSN
0022-328X

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Theoretical study on the mechanism of th
Theoretical study on the mechanism of the 1CHCl + NO reaction
✍ Jian-Jun Liu; Yi-Hong Ding; Yu-Guo Tao; Ji-Kang Feng; Chia-Chung Sun πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 852 KB

## Abstract The complex doublet potential energy surface of the CHClNO system, including 31 minimum isomers and 84 transition states, is investigated at the QCISD(T)/6‐311G(d, p)//B3LYP/6‐31G(d, p) level in order to explore the possible reaction mechanism of the singlet CHCl with NO. Various possib

Theoretical study on the mechanism of th
Theoretical study on the mechanism of the 3CH2 + NO2 reaction
✍ Jian-Jun Liu; Yi-Hong Ding; Yu-Guo Tao; Ji-Kang Feng; Chia-Chung Sun πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 525 KB

## Abstract The complex doublet potential energy surface of the CH~2~NO~2~ system is investigated at the B3LYP/6‐31G(d,p) and QCISD(T)/6‐311G(d,p) (single‐point) levels to explore the possible reaction mechanism of the triplet CH~2~ radical with NO~2~. Forty minimum isomers and 92 transition states