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二环己基铵 3-[(羟甲基)氨基甲酰基]丙酸酯

Dicyclo-hexyl-ammonium 3-[(hy-droxy-meth-yl)carbamo-yl]propano-ate.

作者信息

Rajeswari Subadra, Venkatesa Prabhu Ganesan, Tamilvendan Dhanapal, Stoeckli-Evans Helen

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Nov 6;66(Pt 12):o3096. doi: 10.1107/S1600536810044958.

DOI:10.1107/S1600536810044958
PMID:21589403
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3011642/
Abstract

The title compound, C(12)H(24)N(+)·C(5)H(8)NO(4) (-), contains one dicyclo-hexyl-ammonium cation and one 3-[(hy-droxy-meth-yl)carbamo-yl]propano-ate anion in the asymmetric unit. In the crystal, the ions are linked by inter-molecular N-H⋯O and O-H⋯O hydrogen bonds, forming chains propagating along [100].

摘要

标题化合物C(12)H(24)N⁺·C(5)H(8)NO(4)⁻在不对称单元中包含一个二环己基铵阳离子和一个3-[(羟甲基)氨基甲酰基]丙酸根阴离子。在晶体中,离子通过分子间的N-H⋯O和O-H⋯O氢键相连,形成沿[100]方向延伸的链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8342/3011642/76d7bc678bbd/e-66-o3096-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8342/3011642/3bae649e4713/e-66-o3096-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8342/3011642/76d7bc678bbd/e-66-o3096-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8342/3011642/3bae649e4713/e-66-o3096-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8342/3011642/76d7bc678bbd/e-66-o3096-fig2.jpg

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本文引用的文献

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Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
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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.