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μ-氯代-九-双（μ-4-氯代吡唑基）-双-μ-甲氧基-六铜（II）的晶体结构

Crystal structure of μ-chlorido-nona-kis-(μ-4-chloro-pyrazolato)bis-μ-methoxo-hexa-copper(II).

作者信息

Shi Kaige, Mathivathanan Logesh, Raptis Raphael G

机构信息

Department of Chemistry and Biochemistry, Florida International University, 11200 SW 8th Street, Miami, FL 33199, USA.

出版信息

Acta Crystallogr E Crystallogr Commun. 2017 Jan 27;73(Pt 2):266-269. doi: 10.1107/S2056989017001189. eCollection 2017 Feb 1.

DOI:10.1107/S2056989017001189
PMID:28217356
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC5290579/
Abstract

The hexa-nuclear title compound, [{Cu(μ-OCH)(μ-CHClN)}(μ-CHClN)(μ-Cl)] or [Cu(CHClN)(CHO)Cl], crystallizes in the space group , with individual mol-ecules being located on a twofold rotation axis. The mol-ecule adopts a trigonal prismatic shape, with two trinuclear units linked by three 4-chloro-pyrazolate ligand bridges by encapsulating a Cl anion in a μ-coordination mode. In the crystal, individual mol-ecules are stacked into rods parallel to [1-10] that are arranged in a pseudo-hexa-gonal packing. Cohesion between mol-ecules is accomplished through weak C-H⋯Cl inter-actions.

摘要

六核标题化合物[{Cu(μ - OCH)(μ - CHClN)}(μ - CHClN)(μ - Cl)]或[Cu(CHClN)(CHO)Cl]，结晶于空间群 ，单个分子位于二重旋转轴上。该分子呈三角棱柱形状，两个三核单元通过三个4 - 氯吡唑酸酯配体桥相连，以μ - 配位模式包封一个Cl阴离子。在晶体中，单个分子堆积成平行于[1 - 10]的棒状，呈假六方堆积排列。分子间通过弱C - H⋯Cl相互作用实现凝聚。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/9d692615778a/e-73-00266-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/599130a49a49/e-73-00266-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/7943f3d8368d/e-73-00266-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/9d692615778a/e-73-00266-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/599130a49a49/e-73-00266-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/7943f3d8368d/e-73-00266-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d1de/5290579/9d692615778a/e-73-00266-fig3.jpg

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