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(2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one

Two independent but virtually identical mol­ecules comprise the asymmetric unit in the title compound, C(18)H(15)NOS. With reference to the quinolin-3-yl group, the 3-(thio­phen-2-yl)prop-2-en-1-one residue is almost perpendicular, with all but the carbonyl O atom lying to one side of the plane. Thi...

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Autores principales: Prasath, R., Bhavana, P., Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200943/
https://www.ncbi.nlm.nih.gov/pubmed/22065508
http://dx.doi.org/10.1107/S1600536811031485
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author Prasath, R.
Bhavana, P.
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Prasath, R.
Bhavana, P.
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Prasath, R.
collection PubMed
description Two independent but virtually identical mol­ecules comprise the asymmetric unit in the title compound, C(18)H(15)NOS. With reference to the quinolin-3-yl group, the 3-(thio­phen-2-yl)prop-2-en-1-one residue is almost perpendicular, with all but the carbonyl O atom lying to one side of the plane. This conformation is reflected by the C—C—C—C torsion angles of −102.2 (3) and 81.1 (3)° in the two independent mol­ecules. The dihedral angle formed between the 13 non-H atoms directly associated with the quinolin-3-yl group and the thio­phen-2-yl ring is 87.70 (11)° [83.85 (10)° for the second independent mol­ecule]. The presence of C—H⋯O, C—H⋯N and π–π inter­actions [centroid–centroid distance = 3.5590 (12) Å] lead to supra­molecular chains along the c-axis direction. These are connected along the a-axis direction by C—H⋯π inter­actions. The resultant supra­molecular layers stack along the b axis.
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spelling pubmed-32009432011-11-06 (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one Prasath, R. Bhavana, P. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers Two independent but virtually identical mol­ecules comprise the asymmetric unit in the title compound, C(18)H(15)NOS. With reference to the quinolin-3-yl group, the 3-(thio­phen-2-yl)prop-2-en-1-one residue is almost perpendicular, with all but the carbonyl O atom lying to one side of the plane. This conformation is reflected by the C—C—C—C torsion angles of −102.2 (3) and 81.1 (3)° in the two independent mol­ecules. The dihedral angle formed between the 13 non-H atoms directly associated with the quinolin-3-yl group and the thio­phen-2-yl ring is 87.70 (11)° [83.85 (10)° for the second independent mol­ecule]. The presence of C—H⋯O, C—H⋯N and π–π inter­actions [centroid–centroid distance = 3.5590 (12) Å] lead to supra­molecular chains along the c-axis direction. These are connected along the a-axis direction by C—H⋯π inter­actions. The resultant supra­molecular layers stack along the b axis. International Union of Crystallography 2011-08-11 /pmc/articles/PMC3200943/ /pubmed/22065508 http://dx.doi.org/10.1107/S1600536811031485 Text en © Prasath 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
Prasath, R.
Bhavana, P.
Ng, Seik Weng
Tiekink, Edward R. T.
(2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title_full (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title_fullStr (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title_full_unstemmed (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title_short (2E)-1-(2,4-Dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
title_sort (2e)-1-(2,4-dimethyl­quinolin-3-yl)-3-(thio­phen-2-yl)prop-2-en-1-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200943/
https://www.ncbi.nlm.nih.gov/pubmed/22065508
http://dx.doi.org/10.1107/S1600536811031485
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