Possibilities of tetra-, penta-, and hexacoordination in quantum-chemical simulation of mechanism of formation and stereoisomerization of bisligand azomethine complexes of Zn(II), Cd(II), and Hg(II)
- 作者: Kharabayev N.1
-
隶属关系:
- Research Institute of Physical and Organic Chemistry
- 期: 卷 87, 编号 4 (2017)
- 页面: 756-763
- 栏目: Article
- URL: https://journals.rcsi.science/1070-3632/article/view/219237
- DOI: https://doi.org/10.1134/S1070363217040156
- ID: 219237
如何引用文章
详细
The competition between tetra-, penta-, and hexacoordination with the MN2O2, MN2O2X, and MN2O2X2 (X = S, Se) coordination nodes, respectively, during the formation of bisligand Zn(II), Cd(II), and Hg(II) complexes with bi- and tridentate heterocyclic azomethines has been studied by means of quantumchemical DFT simulation of the complex formation and further stereoisomerization. It has been found that pentacoordination was favorable for the Cd(II) and Hg(II) complexes, whereas the Zn(II) complexes are tetracoordinate.
作者简介
N. Kharabayev
Research Institute of Physical and Organic Chemistry
编辑信件的主要联系方式.
Email: kharabayev@ipoc.sfedu.ru
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