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2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran

In the title compound, C(15)H(10)BrFO(2)S, the O atom and the methyl group of the methyl­sulfinyl substituent lie on opposite sides of the plane through the benzofuran fragment. The 4-bromo­phenyl ring is rotated out of the benzofuran plane [dihedral angle = 38.98 (8)°], while the structure is stabi...

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Detalles Bibliográficos
Autores principales: Choi, Hong Dae, Seo, Pil Ja, Son, Byeng Wha, Lee, Uk
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970042/
https://www.ncbi.nlm.nih.gov/pubmed/21577502
http://dx.doi.org/10.1107/S1600536809030190
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author Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
author_facet Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
author_sort Choi, Hong Dae
collection PubMed
description In the title compound, C(15)H(10)BrFO(2)S, the O atom and the methyl group of the methyl­sulfinyl substituent lie on opposite sides of the plane through the benzofuran fragment. The 4-bromo­phenyl ring is rotated out of the benzofuran plane [dihedral angle = 38.98 (8)°], while the structure is stabilized by an inter­molecular C—H⋯O hydrogen bond and a Br⋯O halogen bond [3.036 (2) Å] and has an inter­molecular C–H⋯π inter­action between the 4-bromo­phenyl H atom and the benzene ring of an adjacent benzofuran mol­ecule, as well as aromatic π–π inter­actions between the benzene rings of the benzofuran systems [centroid–centroid distance = 3.482 (3) Å].
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spelling pubmed-29700422010-12-30 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran Choi, Hong Dae Seo, Pil Ja Son, Byeng Wha Lee, Uk Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(10)BrFO(2)S, the O atom and the methyl group of the methyl­sulfinyl substituent lie on opposite sides of the plane through the benzofuran fragment. The 4-bromo­phenyl ring is rotated out of the benzofuran plane [dihedral angle = 38.98 (8)°], while the structure is stabilized by an inter­molecular C—H⋯O hydrogen bond and a Br⋯O halogen bond [3.036 (2) Å] and has an inter­molecular C–H⋯π inter­action between the 4-bromo­phenyl H atom and the benzene ring of an adjacent benzofuran mol­ecule, as well as aromatic π–π inter­actions between the benzene rings of the benzofuran systems [centroid–centroid distance = 3.482 (3) Å]. International Union of Crystallography 2009-08-08 /pmc/articles/PMC2970042/ /pubmed/21577502 http://dx.doi.org/10.1107/S1600536809030190 Text en © Choi 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
Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title_full 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title_fullStr 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title_full_unstemmed 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title_short 2-(4-Bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
title_sort 2-(4-bromo­phen­yl)-5-fluoro-3-methyl­sulfinyl-1-benzofuran
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970042/
https://www.ncbi.nlm.nih.gov/pubmed/21577502
http://dx.doi.org/10.1107/S1600536809030190
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