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5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate
In the title compound (alternatively called 4′,5,7-trimethoxyflavone methanol solvate hydrate), C(18)H(16)O(5)·CH(3)OH·H(2)O, the flavone molecule is almost planar, the interplanar angle between the planes of the benzopyran-4-one group and the attached benzene ring being 4.69 (9)°. In the crystal...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971445/ https://www.ncbi.nlm.nih.gov/pubmed/21578297 http://dx.doi.org/10.1107/S1600536809040513 |
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author | Aree, Thammarat Sabphon, Chalisa Sawasdee, Pattara |
author_facet | Aree, Thammarat Sabphon, Chalisa Sawasdee, Pattara |
author_sort | Aree, Thammarat |
collection | PubMed |
description | In the title compound (alternatively called 4′,5,7-trimethoxyflavone methanol solvate hydrate), C(18)H(16)O(5)·CH(3)OH·H(2)O, the flavone molecule is almost planar, the interplanar angle between the planes of the benzopyran-4-one group and the attached benzene ring being 4.69 (9)°. In the crystal, the flavone molecule makes intermolecular C—H⋯O hydrogen bonds to adjacent inversion-related flavone molecules, generating R (2) (2)(8) and R (2) (2)(14) rings and an infinite ribbon. The inversion-related ribbons are stabilized through the interstitial water and methanol molecules via intermolecular O—H⋯O hydrogen bonds, generating R (4) (2)(8) and R (2) (1)(6) rings and C (2) (2)(4) chains, and are further sustained by π–π interactions with an interplanar spacing of 3.365 (2)Å. |
format | Text |
id | pubmed-2971445 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29714452010-12-30 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate Aree, Thammarat Sabphon, Chalisa Sawasdee, Pattara Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound (alternatively called 4′,5,7-trimethoxyflavone methanol solvate hydrate), C(18)H(16)O(5)·CH(3)OH·H(2)O, the flavone molecule is almost planar, the interplanar angle between the planes of the benzopyran-4-one group and the attached benzene ring being 4.69 (9)°. In the crystal, the flavone molecule makes intermolecular C—H⋯O hydrogen bonds to adjacent inversion-related flavone molecules, generating R (2) (2)(8) and R (2) (2)(14) rings and an infinite ribbon. The inversion-related ribbons are stabilized through the interstitial water and methanol molecules via intermolecular O—H⋯O hydrogen bonds, generating R (4) (2)(8) and R (2) (1)(6) rings and C (2) (2)(4) chains, and are further sustained by π–π interactions with an interplanar spacing of 3.365 (2)Å. International Union of Crystallography 2009-10-10 /pmc/articles/PMC2971445/ /pubmed/21578297 http://dx.doi.org/10.1107/S1600536809040513 Text en © Aree et al. 2009 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 Aree, Thammarat Sabphon, Chalisa Sawasdee, Pattara 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title_full | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title_fullStr | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title_full_unstemmed | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title_short | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one methanol solvate monohydrate |
title_sort | 5,7-dimethoxy-2-(4-methoxyphenyl)-4h-1-benzopyran-4-one methanol solvate monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971445/ https://www.ncbi.nlm.nih.gov/pubmed/21578297 http://dx.doi.org/10.1107/S1600536809040513 |
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