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(2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one

In the chalcone title compound, C(18)H(17)BrO(4), the dihedral angle between the mean planes of the 2-bromo- and 3,4,5-trimethoxy-substituted benzene rings is 89.3 (1)°. The angles between the mean plane of the prop-2-en-1-one group and the 2-bromo­phenyl and 3,4,5-trimeth­oxy­phenyl ring planes are...

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Autores principales: Jasinski, Jerry P., Butcher, Ray J., Veena, K., Narayana, B., Yathirajan, H. S.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3006788/
https://www.ncbi.nlm.nih.gov/pubmed/21587901
http://dx.doi.org/10.1107/S160053681002235X
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author Jasinski, Jerry P.
Butcher, Ray J.
Veena, K.
Narayana, B.
Yathirajan, H. S.
author_facet Jasinski, Jerry P.
Butcher, Ray J.
Veena, K.
Narayana, B.
Yathirajan, H. S.
author_sort Jasinski, Jerry P.
collection PubMed
description In the chalcone title compound, C(18)H(17)BrO(4), the dihedral angle between the mean planes of the 2-bromo- and 3,4,5-trimethoxy-substituted benzene rings is 89.3 (1)°. The angles between the mean plane of the prop-2-en-1-one group and the 2-bromo­phenyl and 3,4,5-trimeth­oxy­phenyl ring planes are 59.7 (1) and 40.5 (8)°, respectively. While no classical hydrogen bonds are present, three weak inter­molecular C—H⋯O inter­actions and weak C—H⋯Br and C—H⋯Cg π-ring stacking inter­actions [C—H⋯Cg distance = 3.377 (2) Å] are observed, which contribute to the stability of crystal packing.
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spelling pubmed-30067882010-12-30 (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one Jasinski, Jerry P. Butcher, Ray J. Veena, K. Narayana, B. Yathirajan, H. S. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the chalcone title compound, C(18)H(17)BrO(4), the dihedral angle between the mean planes of the 2-bromo- and 3,4,5-trimethoxy-substituted benzene rings is 89.3 (1)°. The angles between the mean plane of the prop-2-en-1-one group and the 2-bromo­phenyl and 3,4,5-trimeth­oxy­phenyl ring planes are 59.7 (1) and 40.5 (8)°, respectively. While no classical hydrogen bonds are present, three weak inter­molecular C—H⋯O inter­actions and weak C—H⋯Br and C—H⋯Cg π-ring stacking inter­actions [C—H⋯Cg distance = 3.377 (2) Å] are observed, which contribute to the stability of crystal packing. International Union of Crystallography 2010-06-16 /pmc/articles/PMC3006788/ /pubmed/21587901 http://dx.doi.org/10.1107/S160053681002235X Text en © Jasinski et al. 2010 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
Jasinski, Jerry P.
Butcher, Ray J.
Veena, K.
Narayana, B.
Yathirajan, H. S.
(2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title_full (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title_fullStr (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title_full_unstemmed (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title_short (2E)-1-(2-Bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
title_sort (2e)-1-(2-bromo­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3006788/
https://www.ncbi.nlm.nih.gov/pubmed/21587901
http://dx.doi.org/10.1107/S160053681002235X
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