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2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate
The title compound, C(4)H(8)N(5) (+)·C(2)HO(4) (−), was obtained from the reaction of oxalic acid and 2,4-diamino-6-methyl-1,3,5-triazine. The protonated triazine ring is essentially planar with a maximum deviation of 0.035 (1) Å, but the hydrogen oxalate anion is less planar, with a maximum deviati...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344586/ https://www.ncbi.nlm.nih.gov/pubmed/22590348 http://dx.doi.org/10.1107/S1600536812016637 |
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author | Narimani, Leila Yamin, Bohari M. |
author_facet | Narimani, Leila Yamin, Bohari M. |
author_sort | Narimani, Leila |
collection | PubMed |
description | The title compound, C(4)H(8)N(5) (+)·C(2)HO(4) (−), was obtained from the reaction of oxalic acid and 2,4-diamino-6-methyl-1,3,5-triazine. The protonated triazine ring is essentially planar with a maximum deviation of 0.035 (1) Å, but the hydrogen oxalate anion is less planar, with a maximum deviation of 0.131 (1) Å for both carbonyl O atoms. In the crystal, the ions are linked by intermolecular N—H⋯O, N—H⋯N, O—H⋯O and C—H⋯O hydrogen bonds, forming a three-dimensional network. Weak π–π [centroid–centroid distance = 3.763 Å] and C—O⋯π interactions [O⋯centroid = 3.5300 (16) Å, C—O⋯centroid = 132.19 (10)°] are also present. |
format | Online Article Text |
id | pubmed-3344586 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33445862012-05-15 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate Narimani, Leila Yamin, Bohari M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(4)H(8)N(5) (+)·C(2)HO(4) (−), was obtained from the reaction of oxalic acid and 2,4-diamino-6-methyl-1,3,5-triazine. The protonated triazine ring is essentially planar with a maximum deviation of 0.035 (1) Å, but the hydrogen oxalate anion is less planar, with a maximum deviation of 0.131 (1) Å for both carbonyl O atoms. In the crystal, the ions are linked by intermolecular N—H⋯O, N—H⋯N, O—H⋯O and C—H⋯O hydrogen bonds, forming a three-dimensional network. Weak π–π [centroid–centroid distance = 3.763 Å] and C—O⋯π interactions [O⋯centroid = 3.5300 (16) Å, C—O⋯centroid = 132.19 (10)°] are also present. International Union of Crystallography 2012-04-21 /pmc/articles/PMC3344586/ /pubmed/22590348 http://dx.doi.org/10.1107/S1600536812016637 Text en © Narimani and Yamin 2012 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 Narimani, Leila Yamin, Bohari M. 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title | 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title_full | 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title_fullStr | 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title_full_unstemmed | 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title_short | 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
title_sort | 2,4-diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344586/ https://www.ncbi.nlm.nih.gov/pubmed/22590348 http://dx.doi.org/10.1107/S1600536812016637 |
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