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二水合双(1H-咪唑-4-羧酸根-κN,O)锌

Diaqua-bis-(1H-imidazole-4-carboxyl-ato-κN,O)zinc.

作者信息

Shuai Wenlin, Cai Songliang, Zheng Shengrun

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):m897. doi: 10.1107/S1600536811020800. Epub 2011 Jun 11.

Abstract

In the title compound, [Zn(C(4)H(3)N(2)O(2))(2)(H(2)O)(2)], the Zn(II) ion is situated on a twofold rotation axis and exhibits a distorted octa-hedral coordination configuration. The equatorial plane contains two cis-oriented bidentate 1H-imidazole-4-carboxyl-ate ligands and the axial positions are occupied by two coordinated water mol-ecules. In the crystal structure, inter-molecular O-H⋯O and N-H⋯O hydrogen bonds link the mol-ecules into a three-dimensional supra-molecular network. There are π-π inter-actions between the imidazole rings, with a centroid-to-centroid distance of 3.504 (3) Å.

摘要

在标题化合物[Zn(C₄H₃N₂O₂)₂(H₂O)₂]中,Zn(II)离子位于二重旋转轴上,呈现出扭曲的八面体配位构型。赤道平面包含两个顺式取向的双齿1H-咪唑-4-羧酸根配体,轴向位置由两个配位水分子占据。在晶体结构中,分子间的O-H⋯O和N-H⋯O氢键将分子连接成三维超分子网络。咪唑环之间存在π-π相互作用,质心到质心距离为3.504 (3) Å。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f013/3151991/5d88cdd69ec1/e-67-0m897-fig1.jpg

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