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2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate
The asymmetric unit of the title salt, C(6)H(9)N(2) (+)·C(7)H(5)O(6)S(−), contains two crystallographically independent 2-amino-5-methylpyridinium cations and two sulfosalicylate anions. In the crystal structure, the sulfonate group of each 3-carboxy-4-hydroxybenzenesulfonate anion interacts wi...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2010
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007532/ https://www.ncbi.nlm.nih.gov/pubmed/21588438 http://dx.doi.org/10.1107/S1600536810029636 |
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author | Hemamalini, Madhukar Fun, Hoong-Kun |
author_facet | Hemamalini, Madhukar Fun, Hoong-Kun |
author_sort | Hemamalini, Madhukar |
collection | PubMed |
description | The asymmetric unit of the title salt, C(6)H(9)N(2) (+)·C(7)H(5)O(6)S(−), contains two crystallographically independent 2-amino-5-methylpyridinium cations and two sulfosalicylate anions. In the crystal structure, the sulfonate group of each 3-carboxy-4-hydroxybenzenesulfonate anion interacts with the corresponding 2-amino-5-methylpyridinium cation via a pair of N—H⋯O hydrogen bonds, forming an R (2) (2)(8) ring motif. The ionic units are linked by N—H⋯O, O—H⋯O and C—H⋯O hydrogen bonds. Furthermore, the crystal structure is stabilized by π–π interactions between the benzene and pyridine rings [centroid–centroid distances = 3.5579 (8) and 3.8309 (8) Å]. There are also intramolecular O—H⋯O hydrogen bonds in the anions, which generate S(6) ring motifs. |
format | Text |
id | pubmed-3007532 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30075322010-12-30 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate Hemamalini, Madhukar Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title salt, C(6)H(9)N(2) (+)·C(7)H(5)O(6)S(−), contains two crystallographically independent 2-amino-5-methylpyridinium cations and two sulfosalicylate anions. In the crystal structure, the sulfonate group of each 3-carboxy-4-hydroxybenzenesulfonate anion interacts with the corresponding 2-amino-5-methylpyridinium cation via a pair of N—H⋯O hydrogen bonds, forming an R (2) (2)(8) ring motif. The ionic units are linked by N—H⋯O, O—H⋯O and C—H⋯O hydrogen bonds. Furthermore, the crystal structure is stabilized by π–π interactions between the benzene and pyridine rings [centroid–centroid distances = 3.5579 (8) and 3.8309 (8) Å]. There are also intramolecular O—H⋯O hydrogen bonds in the anions, which generate S(6) ring motifs. International Union of Crystallography 2010-07-31 /pmc/articles/PMC3007532/ /pubmed/21588438 http://dx.doi.org/10.1107/S1600536810029636 Text en © Hemamalini and Fun 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 Hemamalini, Madhukar Fun, Hoong-Kun 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title | 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title_full | 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title_fullStr | 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title_full_unstemmed | 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title_short | 2-Amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
title_sort | 2-amino-5-methylpyridinium 3-carboxy-4-hydroxybenzenesulfonate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007532/ https://www.ncbi.nlm.nih.gov/pubmed/21588438 http://dx.doi.org/10.1107/S1600536810029636 |
work_keys_str_mv | AT hemamalinimadhukar 2amino5methylpyridinium3carboxy4hydroxybenzenesulfonate AT funhoongkun 2amino5methylpyridinium3carboxy4hydroxybenzenesulfonate |