5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran
In the title compound, C17H15BrO3S, the dihedral angle between the mean planes of the benzofuran and 3-methylphenyl rings is 77.37 (5)°. In the crystal, molecules are linked via pairs of Br...O [Br...O = 3.335 (2) Å] contacts into inversion dimers. These dimers are further linked by C—H...O hydrogen...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2014-05-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536814008149 |
| _version_ | 1818998367760416768 |
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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, C17H15BrO3S, the dihedral angle between the mean planes of the benzofuran and 3-methylphenyl rings is 77.37 (5)°. In the crystal, molecules are linked via pairs of Br...O [Br...O = 3.335 (2) Å] contacts into inversion dimers. 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 separation = 3.884 (3) Å] into supramolecular chains running along the a-axis direction. |
| first_indexed | 2024-12-20T22:00:24Z |
| format | Article |
| id | doaj.art-148c2942cf7641f9989910557a3601c1 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-20T22:00:24Z |
| publishDate | 2014-05-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-148c2942cf7641f9989910557a3601c12022-12-21T19:25:21ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682014-05-01705o567o56710.1107/S1600536814008149bh24975-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-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, C17H15BrO3S, the dihedral angle between the mean planes of the benzofuran and 3-methylphenyl rings is 77.37 (5)°. In the crystal, molecules are linked via pairs of Br...O [Br...O = 3.335 (2) Å] contacts into inversion dimers. 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 separation = 3.884 (3) Å] into supramolecular chains running along the a-axis direction.http://scripts.iucr.org/cgi-bin/paper?S1600536814008149 |
| spellingShingle | Hong Dae Choi Pil Ja Seo Uk Lee 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran Acta Crystallographica Section E |
| title | 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran |
| title_full | 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran |
| title_fullStr | 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran |
| title_full_unstemmed | 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran |
| title_short | 5-Bromo-2,7-dimethyl-3-(3-methylphenylsulfonyl)-1-benzofuran |
| title_sort | 5 bromo 2 7 dimethyl 3 3 methylphenylsulfonyl 1 benzofuran |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536814008149 |
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