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哌嗪-1,4-二铵双-(2-羧基-1H-吡唑-4-羧酸盐)四水合物

Piperazine-1,4-diium bis-(2-carb-oxy-1H-pyrazole-4-carboxyl-ate) tetra-hydrate.

作者信息

Zhou Xin-Hui

机构信息

Key Laboratory for Organic Electronics & Information Displays (KLOEID) and Institute of Advanced Materials (IAM), Nanjing University of Posts & Telecommunications (NUPT), Nanjing 210046, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 18;66(Pt 10):o2578. doi: 10.1107/S160053681003655X.

DOI:10.1107/S160053681003655X
PMID:21587560
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2983173/
Abstract

The asymmetric unit of the title compound, C(4)H(12)N(2) (2+)·2C(5)H(3)N(2)O(4) (-)·4H(2)O, comprises one-half of a piperazine-1,4-diium cation, which lies on an inversion centre, a 2-carb-oxy-1H-pyrazole-4-carboxyl-ate anion and two water mol-ecules. An extensive network of inter-molecular O-H⋯O, N-H⋯O, N-H⋯N and C-H⋯O hydrogen bonds between the cations, anions and water mol-ecules leads to a three-dimensional supra-molecular framework.

摘要

标题化合物C(4)H(12)N(2) (2+)·2C(5)H(3)N(2)O(4) (-)·4H(2)O的不对称单元包含位于对称中心的哌嗪-1,4-二鎓阳离子的一半、一个2-羧基-1H-吡唑-4-羧酸盐阴离子和两个水分子。阳离子、阴离子和水分子之间广泛的分子间O-H⋯O、N-H⋯O、N-H⋯N和C-H⋯O氢键形成了一个三维超分子框架。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4f5a/2983173/9e12c06d1415/e-66-o2578-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4f5a/2983173/f50560f0670e/e-66-o2578-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4f5a/2983173/9e12c06d1415/e-66-o2578-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4f5a/2983173/f50560f0670e/e-66-o2578-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4f5a/2983173/9e12c06d1415/e-66-o2578-fig2.jpg

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