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5-Amino-1H-pyrazol-2-ium hydrogen succinate
In the cation of the title salt, C(3)H(6)N(3) (+)·C(4)H(5)O(4) (−), the protonated pyrazolium ring is planar (r.m.s. deviation = 0.012 Å). An intramolecular C—H⋯O hydrogen bond occurs in the anion. In the crystal, N—H⋯O hydrogen bonds and a weak C—H⋯O interaction between the cations and anions for...
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/PMC3998361/ https://www.ncbi.nlm.nih.gov/pubmed/24764922 http://dx.doi.org/10.1107/S1600536814001615 |
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author | Yamuna, Thammarse S. Kaur, Manpreet Anderson, Brian J. Jasinski, Jerry P. Yathirajan, H. S. |
author_facet | Yamuna, Thammarse S. Kaur, Manpreet Anderson, Brian J. Jasinski, Jerry P. Yathirajan, H. S. |
author_sort | Yamuna, Thammarse S. |
collection | PubMed |
description | In the cation of the title salt, C(3)H(6)N(3) (+)·C(4)H(5)O(4) (−), the protonated pyrazolium ring is planar (r.m.s. deviation = 0.012 Å). An intramolecular C—H⋯O hydrogen bond occurs in the anion. In the crystal, N—H⋯O hydrogen bonds and a weak C—H⋯O interaction between the cations and anions form two sets of R (2) (2)(8) graph-set ring motifs. Intermolecular O—H⋯O hydrogen bonds between these lead to a criss-cross pattern along the b axis. In addition to the classical hydrogen bonds, a weak C—H⋯π(pyrazolium) interaction is observed and contributes to crystal packing. All of these interactions link the molecules into a two-dimensional supramolecular framework parallel to (10-1). |
format | Online Article Text |
id | pubmed-3998361 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-39983612014-04-24 5-Amino-1H-pyrazol-2-ium hydrogen succinate Yamuna, Thammarse S. Kaur, Manpreet Anderson, Brian J. Jasinski, Jerry P. Yathirajan, H. S. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the cation of the title salt, C(3)H(6)N(3) (+)·C(4)H(5)O(4) (−), the protonated pyrazolium ring is planar (r.m.s. deviation = 0.012 Å). An intramolecular C—H⋯O hydrogen bond occurs in the anion. In the crystal, N—H⋯O hydrogen bonds and a weak C—H⋯O interaction between the cations and anions form two sets of R (2) (2)(8) graph-set ring motifs. Intermolecular O—H⋯O hydrogen bonds between these lead to a criss-cross pattern along the b axis. In addition to the classical hydrogen bonds, a weak C—H⋯π(pyrazolium) interaction is observed and contributes to crystal packing. All of these interactions link the molecules into a two-dimensional supramolecular framework parallel to (10-1). International Union of Crystallography 2014-01-29 /pmc/articles/PMC3998361/ /pubmed/24764922 http://dx.doi.org/10.1107/S1600536814001615 Text en © Yamuna 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 | Organic Papers Yamuna, Thammarse S. Kaur, Manpreet Anderson, Brian J. Jasinski, Jerry P. Yathirajan, H. S. 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title | 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title_full | 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title_fullStr | 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title_full_unstemmed | 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title_short | 5-Amino-1H-pyrazol-2-ium hydrogen succinate |
title_sort | 5-amino-1h-pyrazol-2-ium hydrogen succinate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998361/ https://www.ncbi.nlm.nih.gov/pubmed/24764922 http://dx.doi.org/10.1107/S1600536814001615 |
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