1,1′-Methyl­enedipyridinium dichloride monohydrate

In the crystal structure of the title salt, C(11)H(12)N(2) (2+)·2Cl(−)·H(2)O, the dication adopts a butterfly shape [dihedral angle between rings = 69.0 (1)°] with the water mol­ecule lying in the V-shaped cavity. Each O—H bond of the water molecule lies parallel to an aromatic ring and forms an O—H...

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Detalles Bibliográficos
Autores principales: Fu, Wen-Zhen, Wang, Wei-Juan, Niu, Yun-Yin, Ng, Seik Weng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979144/
https://www.ncbi.nlm.nih.gov/pubmed/21579240
http://dx.doi.org/10.1107/S1600536810015096
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author Fu, Wen-Zhen
Wang, Wei-Juan
Niu, Yun-Yin
Ng, Seik Weng
author_facet Fu, Wen-Zhen
Wang, Wei-Juan
Niu, Yun-Yin
Ng, Seik Weng
author_sort Fu, Wen-Zhen
collection PubMed
description In the crystal structure of the title salt, C(11)H(12)N(2) (2+)·2Cl(−)·H(2)O, the dication adopts a butterfly shape [dihedral angle between rings = 69.0 (1)°] with the water mol­ecule lying in the V-shaped cavity. Each O—H bond of the water molecule lies parallel to an aromatic ring and forms an O—H⋯Cl inter­action to a chloride anion. The methyl­ene C atom in the dication and the water O atoms lie on special positions of twofold site symmetry.
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spelling pubmed-29791442010-12-30 1,1′-Methyl­enedipyridinium dichloride monohydrate Fu, Wen-Zhen Wang, Wei-Juan Niu, Yun-Yin Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title salt, C(11)H(12)N(2) (2+)·2Cl(−)·H(2)O, the dication adopts a butterfly shape [dihedral angle between rings = 69.0 (1)°] with the water mol­ecule lying in the V-shaped cavity. Each O—H bond of the water molecule lies parallel to an aromatic ring and forms an O—H⋯Cl inter­action to a chloride anion. The methyl­ene C atom in the dication and the water O atoms lie on special positions of twofold site symmetry. International Union of Crystallography 2010-04-30 /pmc/articles/PMC2979144/ /pubmed/21579240 http://dx.doi.org/10.1107/S1600536810015096 Text en © Fu et al. 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Fu, Wen-Zhen
Wang, Wei-Juan
Niu, Yun-Yin
Ng, Seik Weng
1,1′-Methyl­enedipyridinium dichloride monohydrate
title 1,1′-Methyl­enedipyridinium dichloride monohydrate
title_full 1,1′-Methyl­enedipyridinium dichloride monohydrate
title_fullStr 1,1′-Methyl­enedipyridinium dichloride monohydrate
title_full_unstemmed 1,1′-Methyl­enedipyridinium dichloride monohydrate
title_short 1,1′-Methyl­enedipyridinium dichloride monohydrate
title_sort 1,1′-methyl­enedipyridinium dichloride monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979144/
https://www.ncbi.nlm.nih.gov/pubmed/21579240
http://dx.doi.org/10.1107/S1600536810015096
work_keys_str_mv AT fuwenzhen 11methylenedipyridiniumdichloridemonohydrate
AT wangweijuan 11methylenedipyridiniumdichloridemonohydrate
AT niuyunyin 11methylenedipyridiniumdichloridemonohydrate
AT ngseikweng 11methylenedipyridiniumdichloridemonohydrate

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