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Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate
In the title compound, C(10)H(10)N(2)O(6)·H(2)O, the carboxylic acid group and the nitro group are essentially coplanar with the benzene ring [maximum deviation = 0.0264 (9) Å], while the amide group is oriented at a dihedral angle of 9.22 (5)° with respect to the benzene ring. In the crystal, cla...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2014
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257245/ https://www.ncbi.nlm.nih.gov/pubmed/25484831 http://dx.doi.org/10.1107/S160053681402337X |
| _version_ | 1782347709652402176 |
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| author | Zou, Pei Wang, Hong-Yong Luo, Shi-Neng Liu, Ya-Ling Shen, Yong-Jia |
| author_facet | Zou, Pei Wang, Hong-Yong Luo, Shi-Neng Liu, Ya-Ling Shen, Yong-Jia |
| author_sort | Zou, Pei |
| collection | PubMed |
| description | In the title compound, C(10)H(10)N(2)O(6)·H(2)O, the carboxylic acid group and the nitro group are essentially coplanar with the benzene ring [maximum deviation = 0.0264 (9) Å], while the amide group is oriented at a dihedral angle of 9.22 (5)° with respect to the benzene ring. In the crystal, classical O—H⋯O and N—H⋯O hydrogen bonds and weak C—H⋯O interactions link the organic molecules and water molecules of crystallization into a three-dimensional supramolecular architecture. |
| format | Online Article Text |
| id | pubmed-4257245 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2014 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-42572452014-12-05 Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate Zou, Pei Wang, Hong-Yong Luo, Shi-Neng Liu, Ya-Ling Shen, Yong-Jia Acta Crystallogr Sect E Struct Rep Online Data Reports In the title compound, C(10)H(10)N(2)O(6)·H(2)O, the carboxylic acid group and the nitro group are essentially coplanar with the benzene ring [maximum deviation = 0.0264 (9) Å], while the amide group is oriented at a dihedral angle of 9.22 (5)° with respect to the benzene ring. In the crystal, classical O—H⋯O and N—H⋯O hydrogen bonds and weak C—H⋯O interactions link the organic molecules and water molecules of crystallization into a three-dimensional supramolecular architecture. International Union of Crystallography 2014-10-29 /pmc/articles/PMC4257245/ /pubmed/25484831 http://dx.doi.org/10.1107/S160053681402337X Text en © Zou et al. 2014 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 | Data Reports Zou, Pei Wang, Hong-Yong Luo, Shi-Neng Liu, Ya-Ling Shen, Yong-Jia Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title | Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title_full | Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title_fullStr | Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title_full_unstemmed | Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title_short | Crystal structure of N-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| title_sort | crystal structure of n-(2-hydroxyethyl)-5-nitroisophthalamic acid monohydrate |
| topic | Data Reports |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257245/ https://www.ncbi.nlm.nih.gov/pubmed/25484831 http://dx.doi.org/10.1107/S160053681402337X |
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