摘要
用ＭＮＤＯ法研究了ＳｉＨ_３ＮＯ_２和其异构体ＳｉＨ_３ＯＮＯ之间的转化。结果表明，Ｓｉ－Ｎ键的断裂和Ｓｉ－Ｏ键的生成有较小的能垒，反应为放热过程。
MNDO method has been employed to study the reaction pathway and the struc tures of the reactant,the product and the transition state for the reaction of SiH_3NO_2 SiH_3ONO tautomerism. This study has shown that the reactant and the product are stable,and the activation energy of the reaction is very low.
出处
《高等学校化学学报》
SCIE
EI
CAS
CSCD
北大核心
1995年第5期761-764,共4页
Chemical Journal of Chinese Universities
基金
国家自然科学基金
