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(1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one
There are two crystallographically independent molecules in the asymmetric unit of the title bischalcone derivative, C(23)H(26)O(7). The molecules are unsymmetrical and almost planar: the dihedral angle between two benzene rings is 1.04 (7)° in one molecule and 2.31 (7)° in the other. The centra...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2010
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050352/ https://www.ncbi.nlm.nih.gov/pubmed/21522745 http://dx.doi.org/10.1107/S1600536810049299 |
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author | Ruanwas, Pumsak Chantrapromma, Suchada Fun, Hoong-Kun |
author_facet | Ruanwas, Pumsak Chantrapromma, Suchada Fun, Hoong-Kun |
author_sort | Ruanwas, Pumsak |
collection | PubMed |
description | There are two crystallographically independent molecules in the asymmetric unit of the title bischalcone derivative, C(23)H(26)O(7). The molecules are unsymmetrical and almost planar: the dihedral angle between two benzene rings is 1.04 (7)° in one molecule and 2.31 (7)° in the other. The central penta-1,4-dien-3-one fragment makes dihedral angles of 7.61 (7) and 6.82 (7)° with the two adjacent benzene rings in one molecule, while the corresponding values are 7.85 (7) and 9.42 (6)° in the other. In both molecules, the three methoxy groups of the two 2,4,6-trimethoxyphenyl units are coplanar with the attached benzene rings [C—O—C—C- torsion angles of −1.5 (2), −7.2 (2) and 4.1 (2)° in one molecule and −0.7 (2), −5.5 (2) and −0.6 (2)° in the other]. The molecular conformations are stabilized by weak intramolecular C—H⋯O interactions generating two S(6) ring motifs. In the crystal, molecules are linked by weak intermolecular C—H⋯O interactions into zigzag chains parallel to the c axis. The crystal structure is further stabilized by C—H⋯π interactions and π–π interactions with centroid–centroid distances of 3.6433 (8) Å. |
format | Text |
id | pubmed-3050352 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30503522011-04-26 (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one Ruanwas, Pumsak Chantrapromma, Suchada Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers There are two crystallographically independent molecules in the asymmetric unit of the title bischalcone derivative, C(23)H(26)O(7). The molecules are unsymmetrical and almost planar: the dihedral angle between two benzene rings is 1.04 (7)° in one molecule and 2.31 (7)° in the other. The central penta-1,4-dien-3-one fragment makes dihedral angles of 7.61 (7) and 6.82 (7)° with the two adjacent benzene rings in one molecule, while the corresponding values are 7.85 (7) and 9.42 (6)° in the other. In both molecules, the three methoxy groups of the two 2,4,6-trimethoxyphenyl units are coplanar with the attached benzene rings [C—O—C—C- torsion angles of −1.5 (2), −7.2 (2) and 4.1 (2)° in one molecule and −0.7 (2), −5.5 (2) and −0.6 (2)° in the other]. The molecular conformations are stabilized by weak intramolecular C—H⋯O interactions generating two S(6) ring motifs. In the crystal, molecules are linked by weak intermolecular C—H⋯O interactions into zigzag chains parallel to the c axis. The crystal structure is further stabilized by C—H⋯π interactions and π–π interactions with centroid–centroid distances of 3.6433 (8) Å. International Union of Crystallography 2010-12-04 /pmc/articles/PMC3050352/ /pubmed/21522745 http://dx.doi.org/10.1107/S1600536810049299 Text en © Ruanwas et al. 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 Ruanwas, Pumsak Chantrapromma, Suchada Fun, Hoong-Kun (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title | (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title_full | (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title_fullStr | (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title_full_unstemmed | (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title_short | (1E,4E)-1,5-Bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
title_sort | (1e,4e)-1,5-bis(2,4,6-trimethoxyphenyl)penta-1,4-dien-3-one |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050352/ https://www.ncbi.nlm.nih.gov/pubmed/21522745 http://dx.doi.org/10.1107/S1600536810049299 |
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