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2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate

In the title compound, C(16)H(18)NO(+)·C(6)H(4)ClO(3)S(−)·H(2)O, the cation exists in an E configuration with respect to the ethenyl bond and is slightly twisted with a dihedral angle of 9.85 (5)° between the pyridinium and the benzene rings. The anion is inclined to the cation with the dihedral ang...

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Autores principales: Chantrapromma, Suchada, Chanawanno, Kullapa, Fun, Hoong-Kun
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051682/
https://www.ncbi.nlm.nih.gov/pubmed/21523166
http://dx.doi.org/10.1107/S1600536810053572
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author Chantrapromma, Suchada
Chanawanno, Kullapa
Fun, Hoong-Kun
author_facet Chantrapromma, Suchada
Chanawanno, Kullapa
Fun, Hoong-Kun
author_sort Chantrapromma, Suchada
collection PubMed
description In the title compound, C(16)H(18)NO(+)·C(6)H(4)ClO(3)S(−)·H(2)O, the cation exists in an E configuration with respect to the ethenyl bond and is slightly twisted with a dihedral angle of 9.85 (5)° between the pyridinium and the benzene rings. The anion is inclined to the cation with the dihedral angles between the benzene ring of the anion and the pyridinium and benzene rings of the cation of 78.33 (6) and 68.73 (6)°, respectively. In the crystal, the cations and anions are arranged alternately into head-to-head ribbons along the c axis, with the cationic ribbons stacked along the b axis. The crystal is consolidated by O—H⋯O hydrogen bonds, weak C—H⋯O and C—H⋯π inter­actions. π–π inter­actions with centroid–centroid distances of 3.6111 (7) and 3.6466 (7) Å are also observed.
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spelling pubmed-30516822011-04-26 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate Chantrapromma, Suchada Chanawanno, Kullapa Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(18)NO(+)·C(6)H(4)ClO(3)S(−)·H(2)O, the cation exists in an E configuration with respect to the ethenyl bond and is slightly twisted with a dihedral angle of 9.85 (5)° between the pyridinium and the benzene rings. The anion is inclined to the cation with the dihedral angles between the benzene ring of the anion and the pyridinium and benzene rings of the cation of 78.33 (6) and 68.73 (6)°, respectively. In the crystal, the cations and anions are arranged alternately into head-to-head ribbons along the c axis, with the cationic ribbons stacked along the b axis. The crystal is consolidated by O—H⋯O hydrogen bonds, weak C—H⋯O and C—H⋯π inter­actions. π–π inter­actions with centroid–centroid distances of 3.6111 (7) and 3.6466 (7) Å are also observed. International Union of Crystallography 2011-01-29 /pmc/articles/PMC3051682/ /pubmed/21523166 http://dx.doi.org/10.1107/S1600536810053572 Text en © Chantrapromma 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
Chantrapromma, Suchada
Chanawanno, Kullapa
Fun, Hoong-Kun
2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title_full 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title_fullStr 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title_full_unstemmed 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title_short 2-[(E)-2-(4-Eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
title_sort 2-[(e)-2-(4-eth­oxy­phen­yl)ethen­yl]-1-methyl­pyridinium 4-chloro­benzene­sulfonate monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051682/
https://www.ncbi.nlm.nih.gov/pubmed/21523166
http://dx.doi.org/10.1107/S1600536810053572
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