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N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate
In the title hydrated Schiff base, C(13)H(12)N(4)O(3)·H(2)O, the dihedral angle between the aromatic rings is 5.06 (11)° and an intramolecular O—H⋯N hydrogen bond closes an S(6) ring. In the crystal, O(w)—H⋯O and O(w)—H⋯N (w = water) hydrogen bonds link the components into centrosymmetric tetramer...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2020
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462138/ https://www.ncbi.nlm.nih.gov/pubmed/36337721 http://dx.doi.org/10.1107/S2414314619017310 |
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author | Wang, Zhaodong |
author_facet | Wang, Zhaodong |
author_sort | Wang, Zhaodong |
collection | PubMed |
description | In the title hydrated Schiff base, C(13)H(12)N(4)O(3)·H(2)O, the dihedral angle between the aromatic rings is 5.06 (11)° and an intramolecular O—H⋯N hydrogen bond closes an S(6) ring. In the crystal, O(w)—H⋯O and O(w)—H⋯N (w = water) hydrogen bonds link the components into centrosymmetric tetramers (two Schiff bases and two water molecules). Longer N—H⋯O hydrogen bonds link the tetramers into [010] chains. A weak C—H⋯O hydrogen bond and aromatic π–π stacking between the pyrazine and phenyl rings [centroid–centroid separations = 3.604 (2) and 3.715 (2) Å] are also observed. [Image: see text] |
format | Online Article Text |
id | pubmed-9462138 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-94621382022-11-04 N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate Wang, Zhaodong IUCrdata Data Reports In the title hydrated Schiff base, C(13)H(12)N(4)O(3)·H(2)O, the dihedral angle between the aromatic rings is 5.06 (11)° and an intramolecular O—H⋯N hydrogen bond closes an S(6) ring. In the crystal, O(w)—H⋯O and O(w)—H⋯N (w = water) hydrogen bonds link the components into centrosymmetric tetramers (two Schiff bases and two water molecules). Longer N—H⋯O hydrogen bonds link the tetramers into [010] chains. A weak C—H⋯O hydrogen bond and aromatic π–π stacking between the pyrazine and phenyl rings [centroid–centroid separations = 3.604 (2) and 3.715 (2) Å] are also observed. [Image: see text] International Union of Crystallography 2020-01-10 /pmc/articles/PMC9462138/ /pubmed/36337721 http://dx.doi.org/10.1107/S2414314619017310 Text en © Zhaodong Wang 2020 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Data Reports Wang, Zhaodong N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title |
N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title_full |
N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title_fullStr |
N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title_full_unstemmed |
N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title_short |
N′-(2-Hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
title_sort | n′-(2-hydroxy-3-methoxybenzylidene)pyrazine-2-carbohydrazide monohydrate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462138/ https://www.ncbi.nlm.nih.gov/pubmed/36337721 http://dx.doi.org/10.1107/S2414314619017310 |
work_keys_str_mv | AT wangzhaodong n2hydroxy3methoxybenzylidenepyrazine2carbohydrazidemonohydrate |