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(E)-1-Methyl-4-styrylpyridinium iodide monohydrate
In the title compound, C(14)H(14)N(+)·I(−)·H(2)O, the cation is essentially planar, with a dihedral angle of 2.55 (7)° between the pyridinium and phenyl rings, and exists in an E configuration with respect to the ethenyl bond. In the crystal structure, the cations are stacked in an antiparallel man...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971221/ https://www.ncbi.nlm.nih.gov/pubmed/21578284 http://dx.doi.org/10.1107/S1600536809040446 |
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author | Fun, Hoong-Kun Chantrapromma, Suchada Surasit, Chanasuk Chanawanno, Kullapa |
author_facet | Fun, Hoong-Kun Chantrapromma, Suchada Surasit, Chanasuk Chanawanno, Kullapa |
author_sort | Fun, Hoong-Kun |
collection | PubMed |
description | In the title compound, C(14)H(14)N(+)·I(−)·H(2)O, the cation is essentially planar, with a dihedral angle of 2.55 (7)° between the pyridinium and phenyl rings, and exists in an E configuration with respect to the ethenyl bond. In the crystal structure, the cations are stacked in an antiparallel manner along the a axis. The cation is linked to the water molecule by a weak C—H⋯O interaction, and the water molecule is further linked to the I(−) ion by O—H⋯I hydrogen bonds. The crystal structure is consolidated by these interactions and is further stabilized by a π–π interaction between the pyridinium and phenyl rings with a centroid–centroid distance of 3.6850 (8) Å. |
format | Text |
id | pubmed-2971221 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29712212010-12-30 (E)-1-Methyl-4-styrylpyridinium iodide monohydrate Fun, Hoong-Kun Chantrapromma, Suchada Surasit, Chanasuk Chanawanno, Kullapa Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(14)N(+)·I(−)·H(2)O, the cation is essentially planar, with a dihedral angle of 2.55 (7)° between the pyridinium and phenyl rings, and exists in an E configuration with respect to the ethenyl bond. In the crystal structure, the cations are stacked in an antiparallel manner along the a axis. The cation is linked to the water molecule by a weak C—H⋯O interaction, and the water molecule is further linked to the I(−) ion by O—H⋯I hydrogen bonds. The crystal structure is consolidated by these interactions and is further stabilized by a π–π interaction between the pyridinium and phenyl rings with a centroid–centroid distance of 3.6850 (8) Å. International Union of Crystallography 2009-10-10 /pmc/articles/PMC2971221/ /pubmed/21578284 http://dx.doi.org/10.1107/S1600536809040446 Text en © Fun et al. 2009 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 Chantrapromma, Suchada Surasit, Chanasuk Chanawanno, Kullapa (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title | (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title_full | (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title_fullStr | (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title_full_unstemmed | (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title_short | (E)-1-Methyl-4-styrylpyridinium iodide monohydrate |
title_sort | (e)-1-methyl-4-styrylpyridinium iodide monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971221/ https://www.ncbi.nlm.nih.gov/pubmed/21578284 http://dx.doi.org/10.1107/S1600536809040446 |
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