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2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate
In the crystal structure of the title compound, C(6)H(10)N(3) (+)·C(7)H(2)I(3)O(2) (−)·C(7)H(3)I(3)O(2), two R (2) (2)(8) motifs are observed. One is generated by the interaction of the 2-amino-4,6-dimethylpyrimidin-1-ium cation with the carboxylate group of the 2,3,5-triiodobenzoate anion via N...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238899/ https://www.ncbi.nlm.nih.gov/pubmed/22199752 http://dx.doi.org/10.1107/S160053681104534X |
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author | Malathy, Sevaiyan Muthiah, Packianathan Thomas |
author_facet | Malathy, Sevaiyan Muthiah, Packianathan Thomas |
author_sort | Malathy, Sevaiyan |
collection | PubMed |
description | In the crystal structure of the title compound, C(6)H(10)N(3) (+)·C(7)H(2)I(3)O(2) (−)·C(7)H(3)I(3)O(2), two R (2) (2)(8) motifs are observed. One is generated by the interaction of the 2-amino-4,6-dimethylpyrimidin-1-ium cation with the carboxylate group of the 2,3,5-triiodobenzoate anion via N—H⋯O hydrogen bonds. The other R (2) (2)(8) motif is formed by the interaction of two centrosymmentrically related pyrimidine moieties through N—H⋯N hydrogen bonds. The two motifs combine to form a linear heterotetrameric unit. Heterotetrameric units are linked by a carboxyl–carboxylate O—H⋯O hydrogen bond (involving the O—H group of neutral 2,3,5-triiodobenzoic acid and an O atom of the anion), forming a supramolecular chain along the a axis. In addition, components are held by weak I⋯O interactions in the range 3.023 (5) to 3.382 (5) Å and I⋯I interactions in the range 3.6327 (7) to 4.0025 (8) Å. |
format | Online Article Text |
id | pubmed-3238899 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32388992011-12-23 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate Malathy, Sevaiyan Muthiah, Packianathan Thomas Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title compound, C(6)H(10)N(3) (+)·C(7)H(2)I(3)O(2) (−)·C(7)H(3)I(3)O(2), two R (2) (2)(8) motifs are observed. One is generated by the interaction of the 2-amino-4,6-dimethylpyrimidin-1-ium cation with the carboxylate group of the 2,3,5-triiodobenzoate anion via N—H⋯O hydrogen bonds. The other R (2) (2)(8) motif is formed by the interaction of two centrosymmentrically related pyrimidine moieties through N—H⋯N hydrogen bonds. The two motifs combine to form a linear heterotetrameric unit. Heterotetrameric units are linked by a carboxyl–carboxylate O—H⋯O hydrogen bond (involving the O—H group of neutral 2,3,5-triiodobenzoic acid and an O atom of the anion), forming a supramolecular chain along the a axis. In addition, components are held by weak I⋯O interactions in the range 3.023 (5) to 3.382 (5) Å and I⋯I interactions in the range 3.6327 (7) to 4.0025 (8) Å. International Union of Crystallography 2011-11-09 /pmc/articles/PMC3238899/ /pubmed/22199752 http://dx.doi.org/10.1107/S160053681104534X Text en © Malathy and Muthiah 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 Malathy, Sevaiyan Muthiah, Packianathan Thomas 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title | 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title_full | 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title_fullStr | 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title_full_unstemmed | 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title_short | 2-Amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
title_sort | 2-amino-4,6-dimethylpyrimidin-1-ium 2,3,5-triiodobenzoate 2,3,5-triiodobenzoic acid monosolvate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238899/ https://www.ncbi.nlm.nih.gov/pubmed/22199752 http://dx.doi.org/10.1107/S160053681104534X |
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