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5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran
In the title compound, C(15)H(10)FIO(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-iodophenyl ring is rotated out of the benzofuran plane by a dihedral angle of 39.4 (1)°. The crystal structure is st...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970055/ https://www.ncbi.nlm.nih.gov/pubmed/21577530 http://dx.doi.org/10.1107/S1600536809030992 |
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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)FIO(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-iodophenyl ring is rotated out of the benzofuran plane by a dihedral angle of 39.4 (1)°. The crystal structure is stabilized by an intermolecular C—H⋯O hydrogen bond and an I⋯O halogen bond [3.055 (2) Å]. The crystal structure also exhibits an intermolecular C—H⋯π interaction between the methyl H atom and the 4-iodophenyl ring of an adjacent benzofuran molecule, and aromatic π–π interactions between the benzene rings of neighbouring benzofuran systems [centroid–centroid distance = 3.558 (3) Å]. |
format | Text |
id | pubmed-2970055 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29700552010-12-30 5-Fluoro-2-(4-iodophenyl)-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)FIO(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-iodophenyl ring is rotated out of the benzofuran plane by a dihedral angle of 39.4 (1)°. The crystal structure is stabilized by an intermolecular C—H⋯O hydrogen bond and an I⋯O halogen bond [3.055 (2) Å]. The crystal structure also exhibits an intermolecular C—H⋯π interaction between the methyl H atom and the 4-iodophenyl ring of an adjacent benzofuran molecule, and aromatic π–π interactions between the benzene rings of neighbouring benzofuran systems [centroid–centroid distance = 3.558 (3) Å]. International Union of Crystallography 2009-08-08 /pmc/articles/PMC2970055/ /pubmed/21577530 http://dx.doi.org/10.1107/S1600536809030992 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 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title | 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title_full | 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title_fullStr | 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title_full_unstemmed | 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title_short | 5-Fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
title_sort | 5-fluoro-2-(4-iodophenyl)-3-methylsulfinyl-1-benzofuran |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970055/ https://www.ncbi.nlm.nih.gov/pubmed/21577530 http://dx.doi.org/10.1107/S1600536809030992 |
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