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5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1)
The asymmetric unit of the title compound, 2C(10)H(11)N(2) (+)·2C(3)H(3)O(4) (−)·C(3)H(4)O(4), consists of one 5-amino-6-methylquinolin-1-ium cation, one hydrogen malonate (2-carboxyacetate) anion and one-half molecule of malonic acid which lies on a twofold rotation axis. The quinoline ring sys...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588490/ https://www.ncbi.nlm.nih.gov/pubmed/23476518 http://dx.doi.org/10.1107/S1600536813002547 |
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author | Thanigaimani, Kaliyaperumal Khalib, Nuridayanti Che Arshad, Suhana Razak, Ibrahim Abdul |
author_facet | Thanigaimani, Kaliyaperumal Khalib, Nuridayanti Che Arshad, Suhana Razak, Ibrahim Abdul |
author_sort | Thanigaimani, Kaliyaperumal |
collection | PubMed |
description | The asymmetric unit of the title compound, 2C(10)H(11)N(2) (+)·2C(3)H(3)O(4) (−)·C(3)H(4)O(4), consists of one 5-amino-6-methylquinolin-1-ium cation, one hydrogen malonate (2-carboxyacetate) anion and one-half molecule of malonic acid which lies on a twofold rotation axis. The quinoline ring system is essentially planar, with a maximum deviation of 0.062 (2) Å for all non-H atoms. In the anion, an intramolecular O—H⋯O hydrogen bond generates an S(6) ring. In the crystal, the components are linked via N—H⋯O and O—H⋯O hydrogen bonds into layers parallel to the ac plane. The crystal structure also features weak C—H⋯O hydrogen bonds and a π–π stacking interaction with a centroid–centroid distance of 3.8189 (10) Å. |
format | Online Article Text |
id | pubmed-3588490 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35884902013-03-08 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) Thanigaimani, Kaliyaperumal Khalib, Nuridayanti Che Arshad, Suhana Razak, Ibrahim Abdul Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, 2C(10)H(11)N(2) (+)·2C(3)H(3)O(4) (−)·C(3)H(4)O(4), consists of one 5-amino-6-methylquinolin-1-ium cation, one hydrogen malonate (2-carboxyacetate) anion and one-half molecule of malonic acid which lies on a twofold rotation axis. The quinoline ring system is essentially planar, with a maximum deviation of 0.062 (2) Å for all non-H atoms. In the anion, an intramolecular O—H⋯O hydrogen bond generates an S(6) ring. In the crystal, the components are linked via N—H⋯O and O—H⋯O hydrogen bonds into layers parallel to the ac plane. The crystal structure also features weak C—H⋯O hydrogen bonds and a π–π stacking interaction with a centroid–centroid distance of 3.8189 (10) Å. International Union of Crystallography 2013-02-02 /pmc/articles/PMC3588490/ /pubmed/23476518 http://dx.doi.org/10.1107/S1600536813002547 Text en © Thanigaimani et al. 2013 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 Thanigaimani, Kaliyaperumal Khalib, Nuridayanti Che Arshad, Suhana Razak, Ibrahim Abdul 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title | 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title_full | 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title_fullStr | 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title_full_unstemmed | 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title_short | 5-Amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
title_sort | 5-amino-6-methylquinolin-1-ium hydrogen malonate–malonic acid (2/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588490/ https://www.ncbi.nlm.nih.gov/pubmed/23476518 http://dx.doi.org/10.1107/S1600536813002547 |
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