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Creatininium 2-chloroacetate
In the title compound (systematic name: 2-amino-1-methyl-4-oxo-4,5-dihydro-1H-imidazol-3-ium 2-chloroacetate), C(4)H(8)N(3)O(+)·C(2)H(2)ClO(2) (−), the molecular aggregations are stabilized through classical (N—H⋯O) and non-classical (C—H⋯O and C—H⋯N) hydrogen-bonding interactions. The cations a...
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/PMC3344436/ https://www.ncbi.nlm.nih.gov/pubmed/22590198 http://dx.doi.org/10.1107/S1600536812012068 |
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author | Ali, A. Jahubar Athimoolam, S. Bahadur, S. Asath |
author_facet | Ali, A. Jahubar Athimoolam, S. Bahadur, S. Asath |
author_sort | Ali, A. Jahubar |
collection | PubMed |
description | In the title compound (systematic name: 2-amino-1-methyl-4-oxo-4,5-dihydro-1H-imidazol-3-ium 2-chloroacetate), C(4)H(8)N(3)O(+)·C(2)H(2)ClO(2) (−), the molecular aggregations are stabilized through classical (N—H⋯O) and non-classical (C—H⋯O and C—H⋯N) hydrogen-bonding interactions. The cations are linked to the anions, forming ion pairs through two N—H⋯O bonds that produce characteristic R (2) (2)(8) ring motifs. These cation–anion pairs are connected through another N—H⋯O hydrogen bond, leading to an R (4) (2)(8) ring motif. Further weak C—H⋯N interactions link the molecules along the a axis, while other C—H⋯O interactions generate zigzag chains extending along b. |
format | Online Article Text |
id | pubmed-3344436 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33444362012-05-15 Creatininium 2-chloroacetate Ali, A. Jahubar Athimoolam, S. Bahadur, S. Asath Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound (systematic name: 2-amino-1-methyl-4-oxo-4,5-dihydro-1H-imidazol-3-ium 2-chloroacetate), C(4)H(8)N(3)O(+)·C(2)H(2)ClO(2) (−), the molecular aggregations are stabilized through classical (N—H⋯O) and non-classical (C—H⋯O and C—H⋯N) hydrogen-bonding interactions. The cations are linked to the anions, forming ion pairs through two N—H⋯O bonds that produce characteristic R (2) (2)(8) ring motifs. These cation–anion pairs are connected through another N—H⋯O hydrogen bond, leading to an R (4) (2)(8) ring motif. Further weak C—H⋯N interactions link the molecules along the a axis, while other C—H⋯O interactions generate zigzag chains extending along b. International Union of Crystallography 2012-04-04 /pmc/articles/PMC3344436/ /pubmed/22590198 http://dx.doi.org/10.1107/S1600536812012068 Text en © Ali et al. 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 Ali, A. Jahubar Athimoolam, S. Bahadur, S. Asath Creatininium 2-chloroacetate |
title | Creatininium 2-chloroacetate |
title_full | Creatininium 2-chloroacetate |
title_fullStr | Creatininium 2-chloroacetate |
title_full_unstemmed | Creatininium 2-chloroacetate |
title_short | Creatininium 2-chloroacetate |
title_sort | creatininium 2-chloroacetate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344436/ https://www.ncbi.nlm.nih.gov/pubmed/22590198 http://dx.doi.org/10.1107/S1600536812012068 |
work_keys_str_mv | AT aliajahubar creatininium2chloroacetate AT athimoolams creatininium2chloroacetate AT bahadursasath creatininium2chloroacetate |