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双((E)-2-{5,5-二甲基-3-[4-(1H-1,2,4-三唑-1-基-κN(4))苯乙烯基]环己-2-烯基亚基}丙二腈)-二碘汞(II)

Bis((E)-2-{5,5-di-methyl-3-[4-(1H-1,2,4-triazol-1-yl-κN (4))styr-yl]cyclo-hex-2-enyl-idene}malono-nitrile)-diiodido-mercury(II).

作者信息

Wang Lian-Ke, Zhu Wei-Ju, Zhou Hong-Ping

机构信息

Deparment of Chemistry, Anhui University, Hefei 230039, People's Republic of China and Key Laboratory of Functional Inorganic Materials Chemistry, Hefei 230039, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Sep 21;69(Pt 10):m556-7. doi: 10.1107/S160053681302518X. eCollection 2013.

Abstract

In the title complex, [HgI2(C21H19N5)2], the Hg(II) ion is located on a twofold rotation axis and is coordinated by two I atoms and two N atoms from two (E)-2-{5,5-di-methyl-3-[4-(1H-1,2,4-triazol-1-yl)styr-yl]cyclo-hex-2-enyl-idene}malono-nitrile ligands in a distorted tetra-hedral geometry. In the crystal, the mol-ecules are linked by inter-molecular π-π inter-actions between the triazole and benzene rings [centroid-centroid distance = 3.794 (3) Å] into a band extending in [010]. These bands are further connected by C-H⋯N hydrogen bonds into a two-dimensional network parallel to (100).

摘要

在标题配合物[HgI₂(C₂₁H₁₉N₅)₂]中,Hg(II)离子位于一个二重旋转轴上,由来自两个(E)-2-{5,5-二甲基-3-[4-(1H-1,2,4-三唑-1-基)苯乙烯基]环己-2-烯亚基}丙二腈配体的两个碘原子和两个氮原子以扭曲的四面体几何构型配位。在晶体中,分子通过三唑环和苯环之间的分子间π-π相互作用[质心-质心距离 = 3.794 (3) Å]连接成沿[010]方向延伸的带状结构。这些带状结构通过C-H⋯N氢键进一步连接成平行于(100)的二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cdf8/3790361/bbf15c1bdcd2/e-69-0m556-fig1.jpg

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