Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate
In the title compound, C21H16BrNO3, the mean planes of the anthracene tricycle and isoxazole ring are inclined to each other at a dihedral angle of 72.12 (7)°. The carboxy group is slightly out of the isoxazole mean plane, with a maximum deviation of 0.070 (5) ...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2013-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536813031395 |
| _version_ | 1819293974113812480 |
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| author | Nicholas R. Natale Janet L. Hunting Nathan S. Duncan Matthew J. Weaver Chun Li Michael J. Campbell |
| author_facet | Nicholas R. Natale Janet L. Hunting Nathan S. Duncan Matthew J. Weaver Chun Li Michael J. Campbell |
| author_sort | Nicholas R. Natale |
| collection | DOAJ |
| description | In the title compound, C21H16BrNO3, the mean planes of the anthracene tricycle and isoxazole ring are inclined to each other at a dihedral angle of 72.12 (7)°. The carboxy group is slightly out of the isoxazole mean plane, with a maximum deviation of 0.070 (5) Å for the carbonyl O atom. In the crystal, pairs of weak C—H...O hydrogen bonds link the molecules into dimers, and weak C—H...N interactions further link these dimers into corrugated layers parallel to the bc plane. |
| first_indexed | 2024-12-24T04:18:57Z |
| format | Article |
| id | doaj.art-5e4a5ec02e2b42f4a81874aa8598e63c |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-24T04:18:57Z |
| publishDate | 2013-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-5e4a5ec02e2b42f4a81874aa8598e63c2022-12-21T17:15:52ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-12-016912o1804o180510.1107/S1600536813031395Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylateNicholas R. NataleJanet L. HuntingNathan S. DuncanMatthew J. WeaverChun LiMichael J. CampbellIn the title compound, C21H16BrNO3, the mean planes of the anthracene tricycle and isoxazole ring are inclined to each other at a dihedral angle of 72.12 (7)°. The carboxy group is slightly out of the isoxazole mean plane, with a maximum deviation of 0.070 (5) Å for the carbonyl O atom. In the crystal, pairs of weak C—H...O hydrogen bonds link the molecules into dimers, and weak C—H...N interactions further link these dimers into corrugated layers parallel to the bc plane.http://scripts.iucr.org/cgi-bin/paper?S1600536813031395 |
| spellingShingle | Nicholas R. Natale Janet L. Hunting Nathan S. Duncan Matthew J. Weaver Chun Li Michael J. Campbell Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate Acta Crystallographica Section E |
| title | Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate |
| title_full | Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate |
| title_fullStr | Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate |
| title_full_unstemmed | Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate |
| title_short | Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate |
| title_sort | ethyl 3 10 bromoanthracen 9 yl 5 methyl 1 2 oxazole 4 carboxylate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536813031395 |
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