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一种由苯-1,4-二乙酸和柔性三唑衍生物构建的五重互穿类金刚石三维金属有机框架：聚[[(μ2-苯-1,4-二乙酸根-κ2O:O){μ2-1,4-双[(1H-1,2,4-三唑-1-基)甲基]苯-κ2N4:N4'}锌(II)]一水合物]

A fivefold interpenetrating diamondoid three-dimensional metal-organic framework constructed from benzene-1,4-diacetic acid and flexible triazole derivatives: poly[[(μ2-benzene-1,4-diacetato-κ2O:O){μ2-1,4-bis[(1H-1,2,4-triazol-1-yl)methyl]benzene-κ2N4:N4'}zinc(II)] monohydrate].

作者信息

Shen Hong

机构信息

City Vocational College of Jiangsu, Jiangsu Open University, Nanjing 210036, People's Republic of China.

出版信息

Acta Crystallogr C Struct Chem. 2014 Jan;70(Pt 1):28-30. doi: 10.1107/S2053229613033305. Epub 2013 Dec 14.

DOI:10.1107/S2053229613033305
PMID:24399221
Abstract

In the title mixed-ligand metal-organic polymeric compound, {[Zn(C10H8O4)(C12H14N6)]·H2O}n, the asymmetric unit contains a divalent Zn(II) cation lying on a twofold axis, one half of a fully deprotonated benzene-1,4-diacetate (PBEA) ligand, one half of a 1,4-bis[(1H-1,2,4-triazol-1-yl)methyl]benzene (BTX) ligand and a water molecule, also lying on a twofold axis. Each Zn(II) centre is surrounded by two O-donor atoms from monodentate carboxylate groups belonging to two different PBEA(2-) ligands and by two triazole N-donor atoms from two different BTX ligands. Single-crystal X-ray diffraction analysis revealed that the compound has a fivefold interpenetrating diamondoid three-dimensional metal-organic framework.

摘要

在标题为{[Zn(C₁₀H₈O₄)(C₁₂H₁₄N₆)]·H₂O}ₙ的混合配体金属有机聚合物化合物中，不对称单元包含一个位于二重轴上的二价Zn(II)阳离子、一个完全去质子化的苯-1,4-二乙酸（PBEA）配体的一半、一个1,4-双[(1H-1,2,4-三唑-1-基)甲基]苯（BTX）配体的一半以及一个同样位于二重轴上的水分子。每个Zn(II)中心被来自两个不同PBEA(2-)配体的单齿羧酸盐基团的两个O供体原子以及来自两个不同BTX配体的两个三唑N供体原子所包围。单晶X射线衍射分析表明，该化合物具有五重互穿的类金刚石三维金属有机骨架。

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