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4-Chloro-2-nitrobenzoic acid–pyrazine (2/1)
In the title co-crystal, 2C(7)H(4)ClNO(4)·C(4)H(4)N(2), the pyrazine molecule is located on an inversion centre, so that the asymmetric unit consists of one molecule of 4-chloro-2-nitrobenzoic acid and a half-molecule of pyrazine. The components are connected by O—H⋯N and C—H⋯O hydrogen bonds, f...
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/PMC3238884/ https://www.ncbi.nlm.nih.gov/pubmed/22199737 http://dx.doi.org/10.1107/S1600536811046113 |
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author | Gotoh, Kazuma Ishida, Hiroyuki |
author_facet | Gotoh, Kazuma Ishida, Hiroyuki |
author_sort | Gotoh, Kazuma |
collection | PubMed |
description | In the title co-crystal, 2C(7)H(4)ClNO(4)·C(4)H(4)N(2), the pyrazine molecule is located on an inversion centre, so that the asymmetric unit consists of one molecule of 4-chloro-2-nitrobenzoic acid and a half-molecule of pyrazine. The components are connected by O—H⋯N and C—H⋯O hydrogen bonds, forming a 2:1 unit. In the hydrogen-bonded unit, the dihedral angle between the pyrazine ring and the benzene ring of the benzoic acid is 16.55 (4)°. The units are linked by intermolecular C—H⋯O hydrogen bonds, forming a sheet structure parallel to ([Image: see text]04). A C—H⋯O hydrogen-bond linkage is also observed between these sheets. |
format | Online Article Text |
id | pubmed-3238884 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32388842011-12-23 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) Gotoh, Kazuma Ishida, Hiroyuki Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title co-crystal, 2C(7)H(4)ClNO(4)·C(4)H(4)N(2), the pyrazine molecule is located on an inversion centre, so that the asymmetric unit consists of one molecule of 4-chloro-2-nitrobenzoic acid and a half-molecule of pyrazine. The components are connected by O—H⋯N and C—H⋯O hydrogen bonds, forming a 2:1 unit. In the hydrogen-bonded unit, the dihedral angle between the pyrazine ring and the benzene ring of the benzoic acid is 16.55 (4)°. The units are linked by intermolecular C—H⋯O hydrogen bonds, forming a sheet structure parallel to ([Image: see text]04). A C—H⋯O hydrogen-bond linkage is also observed between these sheets. International Union of Crystallography 2011-11-09 /pmc/articles/PMC3238884/ /pubmed/22199737 http://dx.doi.org/10.1107/S1600536811046113 Text en © Gotoh and Ishida 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 Gotoh, Kazuma Ishida, Hiroyuki 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title | 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title_full | 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title_fullStr | 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title_full_unstemmed | 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title_short | 4-Chloro-2-nitrobenzoic acid–pyrazine (2/1) |
title_sort | 4-chloro-2-nitrobenzoic acid–pyrazine (2/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238884/ https://www.ncbi.nlm.nih.gov/pubmed/22199737 http://dx.doi.org/10.1107/S1600536811046113 |
work_keys_str_mv | AT gotohkazuma 4chloro2nitrobenzoicacidpyrazine21 AT ishidahiroyuki 4chloro2nitrobenzoicacidpyrazine21 |