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聚[哌嗪 - 1,4 - 二铵[μ(4)-氯 - μ(3)-氯 - 三 - μ(2)-氯 - 氯化二镉(II)]]一水合物。

Poly[piperazine-1,4-diium [μ(4)-chlorido-μ(3)-chlorido-tri-μ(2)-chlorido-chloridodicadmate(II)] monohydrate].

作者信息

Adib Marwa, El Glaoui Meher, Pereira da Silva Pedro Sidonio, Ramos Silva Manuela, Ben Nasr Cherif

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Feb 1;68(Pt 2):m175. doi: 10.1107/S1600536812001626. Epub 2012 Jan 21.

DOI:10.1107/S1600536812001626
PMID:22346850
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3274903/
Abstract

In the title compound, {(C(5)H(14)N(2))[Cd(2)Cl(6)]·H(2)O}(n), the asymmetric unit contains one piperazinediium cation, one Cd(2)Cl(6) anion and a water mol-ecule. The coordination geometries of the two Cd(2+) cations are distorted octa-hedral. Adjacent Cd(II) atoms are inter-connected alternately by paired chloride bridges, generating polymeric chains parallel to [010]. Neighbouring chains are connected by O-H⋯Cl hydrogen bonds involving the water mol-ecules, forming layers at z = n/2. The crystal packing is further stabilized by inter-molecular N-H⋯Cl and N-H⋯O hydrogen bonds, one of which is bifurcated.

摘要

在标题化合物{(C₅H₁₄N₂)[Cd₂Cl₆]·H₂O}ₙ中,不对称单元包含一个哌嗪二铵阳离子、一个[Cd₂Cl₆]²⁻阴离子和一个水分子。两个Cd²⁺阳离子的配位几何构型为扭曲八面体。相邻的Cd(II)原子通过成对的氯桥交替相连,形成平行于[010]的聚合物链。相邻的链通过涉及水分子的O—H⋯Cl氢键相连,在z = n/2处形成层。晶体堆积通过分子间的N—H⋯Cl和N—H⋯O氢键进一步稳定,其中一个是分叉的。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/e08332fdced7/e-68-0m175-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/08863d711a4e/e-68-0m175-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/3a8ba201c2e9/e-68-0m175-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/e08332fdced7/e-68-0m175-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/08863d711a4e/e-68-0m175-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/3a8ba201c2e9/e-68-0m175-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e626/3274903/e08332fdced7/e-68-0m175-fig3.jpg

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本文引用的文献

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2-Methyl-piperazinediium tetra-chlorido-zincate(II).四氯合锌酸(II)-2-甲基哌嗪二铵
Acta Crystallogr Sect E Struct Rep Online. 2010 Apr 10;66(Pt 5):m515. doi: 10.1107/S1600536810012547.
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A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
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Bis[2-(3-pyridinio)benzimidazolium] di-mu-chloro-bis[trichlorocadmium(II)].
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