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3 -(1H - 四唑 - 5 - 基)氯化吡啶鎓

3-(1H-Tetra-zol-5-yl)pyridinium chloride.

作者信息

Dai Jing, Yu Miao-Jia

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):o1391. doi: 10.1107/S1600536809018972.

DOI:10.1107/S1600536809018972
PMID:21583237
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2969833/
Abstract

In the cation of the title compound, C(6)H(6)N(5) (+)·Cl(-), the pyridinium and tetra-zole rings are nearly coplanar, making a dihedral angle of 5.05 (12)°. The cations and anions are connected by inter-molecular N-H⋯Cl hydrogen bonds, forming a centrosymmetric [2 + 2] aggregate. The aggregates are stacked along the a axis.

摘要

在标题化合物C(6)H(6)N(5)(+)·Cl(-)的阳离子中,吡啶鎓环和四唑环近乎共面,二面角为5.05 (12)°。阳离子和阴离子通过分子间N-H⋯Cl氢键相连,形成中心对称的[2 + 2]聚集体。这些聚集体沿a轴堆积。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba4c/2969833/3eea8548077b/e-65-o1391-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba4c/2969833/affd26ae885c/e-65-o1391-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba4c/2969833/3eea8548077b/e-65-o1391-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba4c/2969833/affd26ae885c/e-65-o1391-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba4c/2969833/3eea8548077b/e-65-o1391-fig2.jpg

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本文引用的文献

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Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 9;64(Pt 8):o1444. doi: 10.1107/S1600536808017959.
2
Diaqua-[5-(2-pyrid-yl)tetra-zolato-κN,N]manganese(II).二水合-[5-(2-吡啶基)四唑-κN,N]锰(II)
Acta Crystallogr Sect E Struct Rep Online. 2008 May 3;64(Pt 6):m768. doi: 10.1107/S1600536808010106.
3
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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Syntheses, crystal structures, and luminescent properties of three novel zinc coordination polymers with tetrazolyl ligands.三种含四唑基配体的新型锌配位聚合物的合成、晶体结构及发光性质
Inorg Chem. 2005 Jul 25;44(15):5278-85. doi: 10.1021/ic050354x.
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Novel, acentric metal-organic coordination polymers from hydrothermal reactions involving in situ ligand synthesis.通过涉及原位配体合成的水热反应制备的新型无中心金属有机配位聚合物。
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