Cargando…
(3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
The crystal structure of the title compound, C(17)H(16)N(2)O(3)S, exhibits intramolecular C—H⋯S and intermolecular C—H⋯S and C—H⋯O hydrogen bonds, C—S⋯N [S⋯N = 3.033 (2) Å and C—S⋯N = 142.76 (9)°] interactions, and C—H⋯π interactions; these interactions generate S(4), S(6) and R (2) (2)(14) rin...
Autores principales: | , , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2008
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2962057/ https://www.ncbi.nlm.nih.gov/pubmed/21203142 http://dx.doi.org/10.1107/S1600536808020102 |
_version_ | 1782189130377068544 |
---|---|
author | Odabaşoğlu, Mustafa Özkan, Hamdi Yıldırır, Yılmaz Büyükgüngör, Orhan |
author_facet | Odabaşoğlu, Mustafa Özkan, Hamdi Yıldırır, Yılmaz Büyükgüngör, Orhan |
author_sort | Odabaşoğlu, Mustafa |
collection | PubMed |
description | The crystal structure of the title compound, C(17)H(16)N(2)O(3)S, exhibits intramolecular C—H⋯S and intermolecular C—H⋯S and C—H⋯O hydrogen bonds, C—S⋯N [S⋯N = 3.033 (2) Å and C—S⋯N = 142.76 (9)°] interactions, and C—H⋯π interactions; these interactions generate S(4), S(6) and R (2) (2)(14) ring motifs. The isoxazole ring adopts an envelope conformation, with the N atom displaced by 0.672 (2) Å from the plane of the other ring atoms. The thiophene ring is oriented with respect to the succinimide and phenyl rings at dihedral angles of 40.03 (12) and 5.21 (13)°, respectively. The dihedral angle between the succinimide and phenyl rings is 39.38 (12)°. |
format | Text |
id | pubmed-2962057 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29620572010-12-30 (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione Odabaşoğlu, Mustafa Özkan, Hamdi Yıldırır, Yılmaz Büyükgüngör, Orhan Acta Crystallogr Sect E Struct Rep Online Organic Papers The crystal structure of the title compound, C(17)H(16)N(2)O(3)S, exhibits intramolecular C—H⋯S and intermolecular C—H⋯S and C—H⋯O hydrogen bonds, C—S⋯N [S⋯N = 3.033 (2) Å and C—S⋯N = 142.76 (9)°] interactions, and C—H⋯π interactions; these interactions generate S(4), S(6) and R (2) (2)(14) ring motifs. The isoxazole ring adopts an envelope conformation, with the N atom displaced by 0.672 (2) Å from the plane of the other ring atoms. The thiophene ring is oriented with respect to the succinimide and phenyl rings at dihedral angles of 40.03 (12) and 5.21 (13)°, respectively. The dihedral angle between the succinimide and phenyl rings is 39.38 (12)°. International Union of Crystallography 2008-07-05 /pmc/articles/PMC2962057/ /pubmed/21203142 http://dx.doi.org/10.1107/S1600536808020102 Text en © Odabaşoğlu et al. 2008 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 Odabaşoğlu, Mustafa Özkan, Hamdi Yıldırır, Yılmaz Büyükgüngör, Orhan (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title | (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title_full | (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title_fullStr | (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title_full_unstemmed | (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title_short | (3R,3aS,6aR)-2,5-Dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
title_sort | (3r,3as,6ar)-2,5-dimethyl-3-(5-phenyl-2-thienyl)perhydropyrrolo[3,4-d][1,2]oxazole-4,6-dione |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2962057/ https://www.ncbi.nlm.nih.gov/pubmed/21203142 http://dx.doi.org/10.1107/S1600536808020102 |
work_keys_str_mv | AT odabasoglumustafa 3r3as6ar25dimethyl35phenyl2thienylperhydropyrrolo34d12oxazole46dione AT ozkanhamdi 3r3as6ar25dimethyl35phenyl2thienylperhydropyrrolo34d12oxazole46dione AT yıldırıryılmaz 3r3as6ar25dimethyl35phenyl2thienylperhydropyrrolo34d12oxazole46dione AT buyukgungororhan 3r3as6ar25dimethyl35phenyl2thienylperhydropyrrolo34d12oxazole46dione |