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3,4,5-Trimethoxyphenol
The asymmetric unit of the title compound, C(9)H(12)O(4), consists of two crystallographically independent molecules with similar conformations: essentially planar [r.m.s deviations for C(6)O(4) = 0.0057 and 0.0137 Å] except for the central methoxy-methyl group [C—C—O—C torsion angles = 83.3 (2) 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/PMC3515255/ https://www.ncbi.nlm.nih.gov/pubmed/23284475 http://dx.doi.org/10.1107/S1600536812042997 |
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author | Jia, Xiao-Chuan Li, Jing Yu, Zhi-Rui Zhang, Hui Zhou, Lei |
author_facet | Jia, Xiao-Chuan Li, Jing Yu, Zhi-Rui Zhang, Hui Zhou, Lei |
author_sort | Jia, Xiao-Chuan |
collection | PubMed |
description | The asymmetric unit of the title compound, C(9)H(12)O(4), consists of two crystallographically independent molecules with similar conformations: essentially planar [r.m.s deviations for C(6)O(4) = 0.0057 and 0.0137 Å] except for the central methoxy-methyl group [C—C—O—C torsion angles = 83.3 (2) and 83.9 (2)°]. In the crystal, O—H⋯O hydrogen bonds link the molecules, generating supramolecular chains along the b axis.The three-dimensional crystal structure is stabilized by C—H⋯O and C—H⋯π interactions. |
format | Online Article Text |
id | pubmed-3515255 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35152552013-01-02 3,4,5-Trimethoxyphenol Jia, Xiao-Chuan Li, Jing Yu, Zhi-Rui Zhang, Hui Zhou, Lei Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(9)H(12)O(4), consists of two crystallographically independent molecules with similar conformations: essentially planar [r.m.s deviations for C(6)O(4) = 0.0057 and 0.0137 Å] except for the central methoxy-methyl group [C—C—O—C torsion angles = 83.3 (2) and 83.9 (2)°]. In the crystal, O—H⋯O hydrogen bonds link the molecules, generating supramolecular chains along the b axis.The three-dimensional crystal structure is stabilized by C—H⋯O and C—H⋯π interactions. International Union of Crystallography 2012-10-20 /pmc/articles/PMC3515255/ /pubmed/23284475 http://dx.doi.org/10.1107/S1600536812042997 Text en © Jia 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 Jia, Xiao-Chuan Li, Jing Yu, Zhi-Rui Zhang, Hui Zhou, Lei 3,4,5-Trimethoxyphenol |
title | 3,4,5-Trimethoxyphenol |
title_full | 3,4,5-Trimethoxyphenol |
title_fullStr | 3,4,5-Trimethoxyphenol |
title_full_unstemmed | 3,4,5-Trimethoxyphenol |
title_short | 3,4,5-Trimethoxyphenol |
title_sort | 3,4,5-trimethoxyphenol |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3515255/ https://www.ncbi.nlm.nih.gov/pubmed/23284475 http://dx.doi.org/10.1107/S1600536812042997 |
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