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(E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate

The asymmetric unit of the title compound, C(18)H(23)N(2) (+)·C(6)H(5)O(3)S(−)·H(2)O, comprises a 2-[4-(diethyl­amino)­styr­yl]-1-methyl­pyridinium cation, a benzene­sulfonate anion and a solvent water mol­ecule. One ethyl substituent of the diethyl­amino group of the cation is disordered over two p...

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Autores principales: Fun, Hoong-Kun, Kaewmanee, Narissara, Chanawanno, Kullapa, Chantrapromma, Suchada
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051968/
https://www.ncbi.nlm.nih.gov/pubmed/21522353
http://dx.doi.org/10.1107/S1600536811004156
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author Fun, Hoong-Kun
Kaewmanee, Narissara
Chanawanno, Kullapa
Chantrapromma, Suchada
author_facet Fun, Hoong-Kun
Kaewmanee, Narissara
Chanawanno, Kullapa
Chantrapromma, Suchada
author_sort Fun, Hoong-Kun
collection PubMed
description The asymmetric unit of the title compound, C(18)H(23)N(2) (+)·C(6)H(5)O(3)S(−)·H(2)O, comprises a 2-[4-(diethyl­amino)­styr­yl]-1-methyl­pyridinium cation, a benzene­sulfonate anion and a solvent water mol­ecule. One ethyl substituent of the diethyl­amino group of the cation is disordered over two positions in a 0.73789 (9):0.26211 (9) ratio. The cation exists in the E configuration with respect to the C=C bond and the π-conjugated system is essentially planar with a dihedral angle of 0.82 (10)° between the pyridinium and benzene rings. The cation and anion are almost orthogonal with a dihedral angle of 86.71 (10)° between the π-conjugated system of the cation and benzene ring of the anion. In the crystal, mol­ecules are arranged into chains along [001] and adjacent chains are linked by weak C—H⋯O inter­actions. The crystal is further stablilized by O—H⋯O hydrogen bonds and weak C—H⋯π inter­actions.
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spelling pubmed-30519682011-04-26 (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate Fun, Hoong-Kun Kaewmanee, Narissara Chanawanno, Kullapa Chantrapromma, Suchada Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(18)H(23)N(2) (+)·C(6)H(5)O(3)S(−)·H(2)O, comprises a 2-[4-(diethyl­amino)­styr­yl]-1-methyl­pyridinium cation, a benzene­sulfonate anion and a solvent water mol­ecule. One ethyl substituent of the diethyl­amino group of the cation is disordered over two positions in a 0.73789 (9):0.26211 (9) ratio. The cation exists in the E configuration with respect to the C=C bond and the π-conjugated system is essentially planar with a dihedral angle of 0.82 (10)° between the pyridinium and benzene rings. The cation and anion are almost orthogonal with a dihedral angle of 86.71 (10)° between the π-conjugated system of the cation and benzene ring of the anion. In the crystal, mol­ecules are arranged into chains along [001] and adjacent chains are linked by weak C—H⋯O inter­actions. The crystal is further stablilized by O—H⋯O hydrogen bonds and weak C—H⋯π inter­actions. International Union of Crystallography 2011-02-09 /pmc/articles/PMC3051968/ /pubmed/21522353 http://dx.doi.org/10.1107/S1600536811004156 Text en © Fun et al. 2011 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
Fun, Hoong-Kun
Kaewmanee, Narissara
Chanawanno, Kullapa
Chantrapromma, Suchada
(E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title_full (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title_fullStr (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title_full_unstemmed (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title_short (E)-2-[4-(Diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
title_sort (e)-2-[4-(diethyl­amino)­styr­yl]-1-methyl­pyridinium benzene­sulfonate mono­hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051968/
https://www.ncbi.nlm.nih.gov/pubmed/21522353
http://dx.doi.org/10.1107/S1600536811004156
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