Theoretical study on the formation mechanism of Iso-CH2I-Cl
Data(s) |
15/03/2004
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Resumo |
The dissociation and isomerization reaction mechanism on the ground-state potential energy surface for CH2ClI are investigated by ab initio calculations. It is found that the isomer iso-CH2I-Cl can be produced from either the recombination of the photodissociation. fragments or the isomerization reaction of CH2ClI, rather than from isomerization reaction of iso-CH2Cl-I. Further explanations of experimental results are also presented. (C) 2003 Wiley Periodicals, Inc. |
Identificador | |
Idioma(s) |
英语 |
Fonte |
杨光辉;孟庆田;张鑫;韩克利.Theoretical Study on the Formation Mechanism of Iso-CH2I-Cl,International Journal of Quantum Chemistry,2004,97(2):719-724 |
Palavras-Chave | #dissociation reaction of CH2ClI #formation of iso-CH2I-Cl #isomerization reaction of CH2ClI #quantum chemistry calculation |
Tipo |
期刊论文 |