2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran
In the title compound, C21H14FIO2S, the dihedral angles between the mean plane [r.m.s. deviation = 0.007 (1) Å] of the benzofuran fragment and the pendant 4-fluorophenyl and phenyl rings are 3.66 (7) and 82.37 (6)°, respectively. In the cryst...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2013-06-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536813011793 |
| _version_ | 1818907066922696704 |
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| author | Hong Dae Choi Pil Ja Seo Uk Lee |
| author_facet | Hong Dae Choi Pil Ja Seo Uk Lee |
| author_sort | Hong Dae Choi |
| collection | DOAJ |
| description | In the title compound, C21H14FIO2S, the dihedral angles between the mean plane [r.m.s. deviation = 0.007 (1) Å] of the benzofuran fragment and the pendant 4-fluorophenyl and phenyl rings are 3.66 (7) and 82.37 (6)°, respectively. In the crystal, molecules are linked by pairs of C—H...I hydrogen bonds into centrosymmetric dimers, which are further packed into stacks along the b axis by C—H...O hydrogen bonds. In addition, the stacked molecules exhibit inversion-related S...O contacts [2.9627 (14) Å] involving the sulfinyl groups. |
| first_indexed | 2024-12-19T21:49:13Z |
| format | Article |
| id | doaj.art-6c567379d9ce42cfb50a268cbf1a07a5 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-19T21:49:13Z |
| publishDate | 2013-06-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-6c567379d9ce42cfb50a268cbf1a07a52022-12-21T20:04:27ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-06-01696o820o82010.1107/S16005368130117932-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuranHong Dae ChoiPil Ja SeoUk LeeIn the title compound, C21H14FIO2S, the dihedral angles between the mean plane [r.m.s. deviation = 0.007 (1) Å] of the benzofuran fragment and the pendant 4-fluorophenyl and phenyl rings are 3.66 (7) and 82.37 (6)°, respectively. In the crystal, molecules are linked by pairs of C—H...I hydrogen bonds into centrosymmetric dimers, which are further packed into stacks along the b axis by C—H...O hydrogen bonds. In addition, the stacked molecules exhibit inversion-related S...O contacts [2.9627 (14) Å] involving the sulfinyl groups.http://scripts.iucr.org/cgi-bin/paper?S1600536813011793 |
| spellingShingle | Hong Dae Choi Pil Ja Seo Uk Lee 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran Acta Crystallographica Section E |
| title | 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran |
| title_full | 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran |
| title_fullStr | 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran |
| title_full_unstemmed | 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran |
| title_short | 2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran |
| title_sort | 2 4 fluorophenyl 5 iodo 7 methyl 3 phenylsulfinyl 1 benzofuran |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536813011793 |
| work_keys_str_mv | AT hongdaechoi 24fluorophenyl5iodo7methyl3phenylsulfinyl1benzofuran AT piljaseo 24fluorophenyl5iodo7methyl3phenylsulfinyl1benzofuran AT uklee 24fluorophenyl5iodo7methyl3phenylsulfinyl1benzofuran |