5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran

5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran

In the title compound, C18H17BrO2S, the dihedral angle between the methylphenyl ring and the mean plane of the benzofuran rung system is 87.0 (2)°. In the crystal, molecules related by inversion are paired into dimers via C—H...O and C—H...π interactions. These dimers are further linked by C—H...O h...

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Main Authors: Hong Dae Choi, Pil Ja Seo, Uk Lee
Format: Article
Language:English
Published: International Union of Crystallography 2014-04-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536814004310
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spelling doaj-943300ba6aaf42638e7f10bf22f6bc4d2020-11-25T01:13:21ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682014-04-01704o381o38110.1107/S1600536814004310xu57735-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuranHong Dae Choi0Pil Ja Seo1Uk Lee2Department of Chemistry, Dongeui University, San 24 Kaya-dong, Busanjin-gu, Busan 614-714, Republic of KoreaDepartment of Chemistry, Dongeui University, San 24 Kaya-dong, Busanjin-gu, Busan 614-714, Republic of KoreaDepartment of Chemistry, Pukyong National University, 599-1 Daeyeon 3-dong, Nam-gu, Busan 608-737, Republic of KoreaIn the title compound, C18H17BrO2S, the dihedral angle between the methylphenyl ring and the mean plane of the benzofuran rung system is 87.0 (2)°. In the crystal, molecules related by inversion are paired into dimers via C—H...O and C—H...π interactions. These dimers are further linked by C—H...O hydrogen bonds and π–π interactions between the benzene and furan rings of neighbouring molecules [centroid–centroid distance = 3.555 (5) Å], resulting in a three-dimensional supramolecular network.http://scripts.iucr.org/cgi-bin/paper?S1600536814004310
collection DOAJ
language English
format Article
sources DOAJ
author Hong Dae Choi
Pil Ja Seo
Uk Lee
spellingShingle Hong Dae Choi
Pil Ja Seo
Uk Lee
5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
Acta Crystallographica Section E
author_facet Hong Dae Choi
Pil Ja Seo
Uk Lee
author_sort Hong Dae Choi
title 5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
title_short 5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
title_full 5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
title_fullStr 5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
title_full_unstemmed 5-Bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
title_sort 5-bromo-2,4,6-trimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2014-04-01
description In the title compound, C18H17BrO2S, the dihedral angle between the methylphenyl ring and the mean plane of the benzofuran rung system is 87.0 (2)°. In the crystal, molecules related by inversion are paired into dimers via C—H...O and C—H...π interactions. These dimers are further linked by C—H...O hydrogen bonds and π–π interactions between the benzene and furan rings of neighbouring molecules [centroid–centroid distance = 3.555 (5) Å], resulting in a three-dimensional supramolecular network.
url http://scripts.iucr.org/cgi-bin/paper?S1600536814004310
work_keys_str_mv AT hongdaechoi 5bromo246trimethyl34methylphenylsulfinyl1benzofuran
AT piljaseo 5bromo246trimethyl34methylphenylsulfinyl1benzofuran
AT uklee 5bromo246trimethyl34methylphenylsulfinyl1benzofuran
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