高等学校化学学报2001，Vol.22Issue(1)：86-90,5.
巯基类浮选药剂电子结构及其与金属离子作用的量子化学研究
A Quantum Chemistry Study on the Electronic Structure of Mercapto Flotation Reagents and Its Coordination with Metal Ions
摘要
Abstract
The electronic structure of mercapto flotation reagents MBT,MBO,MBM was calculated by use of a quantum chemistry program package,MOAN.As a results,the experiment factors for the stability of isomers of these flotation reagents were explained: the activity site and the role played by benzene ring were discussed and some reasons for that N,O,S on pentahetero ring do not act as a reaction site when coordinating with M(Ⅱ) were also found.Furthermore,the interactions between species above and Pb(Ⅱ),Zn(Ⅱ) as well as some of transition metal ions,Pt (Ⅱ),Fe (Ⅱ),Cu(Ⅱ),were also calculated and discussed here.关键词
巯基类浮选药剂/硫酮/硫醇/量子化学计算分类
矿业与冶金引用本文复制引用
杨刚,龙翔云..巯基类浮选药剂电子结构及其与金属离子作用的量子化学研究[J].高等学校化学学报,2001,22(1):86-90,5.
