The interaction between the molecules ethylene and cis-NzH2 has been studied using a double-zeta gaussian basis in a series of ab initio SCF calculations. The results obtained indicate that the synchronous hydrogen transfer reaction is a onestep reaction having an activation energy of around 60 kcal
β¦ LIBER β¦
Studies of a proposed mechanism for the reaction between 2H-pyran-2-ones and organomagnesium compounds
β Scribed by J. Dreux; P. Lhoste; M. Moreau; J. Royer
- Publisher
- John Wiley and Sons
- Year
- 1985
- Tongue
- English
- Weight
- 252 KB
- Volume
- 6
- Category
- Article
- ISSN
- 0192-8651
No coin nor oath required. For personal study only.
β¦ Synopsis
Part of the reaction between 2H-pyran-2-ones and organomagnesium compounds has been investigated by means of MNDO and ab initio calculations. Criteria for the mechanism of reaction are provided by the stereoselectivity observed and calculations are consistent with this stereoselectivity. Conformations of the reaction intermediates are given.
π SIMILAR VOLUMES
A theoretical study of the chemical reac
β
P.N. Skancke
π
Article
π
1977
π
Elsevier Science
π
English
β 575 KB
Acetyltrimethylsilane: A Novel Reagent f
β
Atul Goel; Deepti Verma; Manish Dixit; Resmi Raghunandan; P. R. Maulik
π
Article
π
2006
π
John Wiley and Sons
β 21 KB
Intensification of a Reaction by the Add
β
Kristof Kranjc; Marijan Kocevar
π
Article
π
2006
π
John Wiley and Sons
β 27 KB
ChemInform Abstract: Hydroalkylation Lea
β
Wei-Bing Liu; Huan-Feng Jiang; Chun-Li Qiao
π
Article
π
2009
π
John Wiley and Sons
β 39 KB
π 1 views
Reaction Mechanism of the Synthesis of A
β
Der-Yan Hwang; Alexander M. Mebel
π
Article
π
2003
π
John Wiley and Sons
β 55 KB
π 2 views
A classical trajectory study of the ion-
β
J.P. Sullivan; E. Herbst
π
Article
π
1978
π
Elsevier Science
π
English
β 349 KB
A ciasGcaI trajectory analysis has been performed on the ion-molecule reaction Cc+ Hz +CH++ H. The results of the calculation are compared with the results of molecular beam experiments\_