2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran

In the title compound, C(16)H(12)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-fluoro­phenyl ring is rotated slightly out of the benzofuran plane, as indicated by the dihedral angle of 7.43 (6)°....

Descripción completa

Detalles Bibliográficos
Autores principales: Choi, Hong Dae, Seo, Pil Ja, Son, Byeng Wha, Lee, Uk
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3006691/
https://www.ncbi.nlm.nih.gov/pubmed/21587905
http://dx.doi.org/10.1107/S1600536810022397
_version_ 1782194198659727360
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(16)H(12)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-fluoro­phenyl ring is rotated slightly out of the benzofuran plane, as indicated by the dihedral angle of 7.43 (6)°. In the crystal structure, pairs of short I⋯O [3.074 (2) Å] contacts link the mol­ecules into centrosymmetric dimers. These dimers are further linked via aromatic π–π inter­actions between the benzene and the 4-fluoro­phenyl rings of neighbouring mol­ecules [centroid–centroid distance = 3.617 (3) Å].
format Text
id pubmed-3006691
institution National Center for Biotechnology Information
language English
publishDate 2010
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-30066912010-12-30 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-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(16)H(12)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-fluoro­phenyl ring is rotated slightly out of the benzofuran plane, as indicated by the dihedral angle of 7.43 (6)°. In the crystal structure, pairs of short I⋯O [3.074 (2) Å] contacts link the mol­ecules into centrosymmetric dimers. These dimers are further linked via aromatic π–π inter­actions between the benzene and the 4-fluoro­phenyl rings of neighbouring mol­ecules [centroid–centroid distance = 3.617 (3) Å]. International Union of Crystallography 2010-06-16 /pmc/articles/PMC3006691/ /pubmed/21587905 http://dx.doi.org/10.1107/S1600536810022397 Text en © Choi 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
Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title_full 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title_fullStr 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title_full_unstemmed 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title_short 2-(4-Fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
title_sort 2-(4-fluoro­phen­yl)-5-iodo-7-methyl-3-methyl­sulfinyl-1-benzofuran
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3006691/
https://www.ncbi.nlm.nih.gov/pubmed/21587905
http://dx.doi.org/10.1107/S1600536810022397
work_keys_str_mv AT choihongdae 24fluorophenyl5iodo7methyl3methylsulfinyl1benzofuran
AT seopilja 24fluorophenyl5iodo7methyl3methylsulfinyl1benzofuran
AT sonbyengwha 24fluorophenyl5iodo7methyl3methylsulfinyl1benzofuran
AT leeuk 24fluorophenyl5iodo7methyl3methylsulfinyl1benzofuran

Ejemplares similares