摘要
采用量子化学的方法,通过对N2H4的所有可能的键角和二面角变化过程进行势能面扫描,获得了相应的能量和构型之间的关系,从而研究了N2H4的异构化机理和构象的变化.
All possible bond angle changes and dihedral angle changes of hydrazine have been studied by quantum chemistry method in this paper. By potential energy surface scan, the relationship bewteen formation and energy has been gained. From this, isomerizafion mechanism and conformation transformation of hydrazine have been studied.
出处
《四川师范大学学报（自然科学版）》
CAS
CSCD
北大核心
2005年第6期704-707,共4页
Journal of Sichuan Normal University（Natural Science）
基金
国家自然科学基金(20277014)资助项目
关键词
N2H4
异构化
构象
量子化学
Hydrazine
Isomerization
Conformation
Quantum chemistry
