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双(5,5,7,12,12,14-六甲基-1,4,8,11-四氮杂环十四烷-κN)(μ-L-苹果酸根-κO,O:O,O)二镍(II)双(高氯酸盐)一水合物

Bis(5,5,7,12,12,14-hexa-methyl-1,4,8,11-tetra-azacyclo-tetra-decane-κN)(μ-l-mal-ato-κO,O:O,O)dinickel(II) bis(perchlorate) monohydrate.

作者信息

Ou Guang-Chuan, Zhou Qiang, Ng Seik Weng

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jun 6;65(Pt 7):m728. doi: 10.1107/S1600536809020662.

DOI:10.1107/S1600536809020662
PMID:21582671
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2969409/
Abstract

In the crystal structure of the title dinuclear compound, Ni(2)(C(4)H(4)O(5))(C(16)H(36)N(4))(2)(2)·H(2)O, the bridg-ing di-car-box-yl-ate dianion O,O'-chelates to two Ni atoms, both of which are also chelated by the N-macrocylic ligand. The Ni atoms exhibit a distorted octa-hedral coordination. N-H⋯O and O-H⋯O hydrogen bonds link the cations and the uncoordinated water mol-ecules into a layer structure; the perchlorate anions occupy the space between adjacent layers, and are only weakly linked to the layers. One of the perchlorate anions is disordered over two sets of sites in a 3:2 ratio.

摘要

在标题双核化合物Ni₂(C₄H₄O₅)(C₁₆H₃₆N₄)₂₂·H₂O的晶体结构中,桥连二羧酸根二价阴离子通过O,O'-螯合与两个Ni原子相连,这两个Ni原子也均被大环N配体螯合。Ni原子呈现出扭曲的八面体配位。N-H⋯O和O-H⋯O氢键将阳离子和未配位的水分子连接成层状结构;高氯酸根阴离子占据相邻层之间的空间,并且仅与这些层存在弱连接。其中一个高氯酸根阴离子在两组位置上无序分布,比例为3:2。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a95a/2969409/4d1c6d0da32c/e-65-0m728-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a95a/2969409/4d1c6d0da32c/e-65-0m728-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a95a/2969409/4d1c6d0da32c/e-65-0m728-fig1.jpg

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A short history of SHELX.SHELX简史。
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