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2-(2-吡咯烷基)-1H-苯并咪唑-3-鎓二硝酸盐

2-(2-Pyrrolidinio)-1H-benzimidazol-3-ium dinitrate.

作者信息

Dai Jing

机构信息

Ordered Matter Science Research Center, College of Chemistry and Chemical Engineering, Southeast University, Nanjing 210096, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 May 23;65(Pt 6):o1360. doi: 10.1107/S1600536809018558.

DOI:10.1107/S1600536809018558
PMID:21583211
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2969558/
Abstract

In the title compound, C(11)H(15)N(3) (2+)·2NO(3) (-), one of the imidazole N atoms and the N atom of the pyrrolidine ring are protonated. The pyrrolidine ring adopts an envelope conformation, with the C atom carrying the benzoimidazolium substituent as the flap atom. In the crystal structure, cations and anions are linked through N-H⋯O hydrogen bonds, forming chains that run parallel to the c axis.

摘要

在标题化合物C(11)H(15)N(3)(2+)·2NO(3)(-)中,咪唑环的一个氮原子和吡咯烷环的氮原子被质子化。吡咯烷环呈信封式构象,携带苯并咪唑鎓取代基的碳原子为折叶原子。在晶体结构中,阳离子和阴离子通过N-H⋯O氢键相连,形成平行于c轴的链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f42e/2969558/016ea2381f2b/e-65-o1360-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f42e/2969558/7484e1924f5c/e-65-o1360-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f42e/2969558/016ea2381f2b/e-65-o1360-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f42e/2969558/7484e1924f5c/e-65-o1360-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f42e/2969558/016ea2381f2b/e-65-o1360-fig2.jpg

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本文引用的文献

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Bis(nitrato-κO)[(S)-2-(pyrrolidin-2-yl)-1H-benzimidazole]cadmium(II).双(硝酸根-κO)[(S)-2-(吡咯烷-2-基)-1H-苯并咪唑]镉(II)
Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 9;64(Pt 8):m1017. doi: 10.1107/S1600536808006454.
2
Dibromido[(S)-2-(pyrrolidin-2-yl)-1H-benzimidazole]zinc(II).二溴化[(S)-2-(吡咯烷-2-基)-1H-苯并咪唑]锌(II)
Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 9;64(Pt 8):m1016. doi: 10.1107/S1600536808019168.
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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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Dielectric anisotropy of a homochiral trinuclear nickel(II) complex.
J Am Chem Soc. 2007 May 2;129(17):5346-7. doi: 10.1021/ja0701816. Epub 2007 Apr 12.