Cargando…

{2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone

The title compound, C(24)H(20)N(2)OS, crystallizes with two independent mol­ecules (A and B) in the asymmetric unit, in each of which the cyclo­hexene rings adopt half-chair conformations. The mean plane of the indole ring is twisted from those of the phenyl and thio­phene rings by 69.0 (7) and 8.3 ...

Descripción completa

Detalles Bibliográficos
Autores principales: Kaur, Manpreet, Jasinski, Jerry P., Yamuna, Thammarse S., Yathirajan, H. S., Byrappa, K.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998588/
https://www.ncbi.nlm.nih.gov/pubmed/24826189
http://dx.doi.org/10.1107/S1600536814006345
_version_ 1782313394092638208
author Kaur, Manpreet
Jasinski, Jerry P.
Yamuna, Thammarse S.
Yathirajan, H. S.
Byrappa, K.
author_facet Kaur, Manpreet
Jasinski, Jerry P.
Yamuna, Thammarse S.
Yathirajan, H. S.
Byrappa, K.
author_sort Kaur, Manpreet
collection PubMed
description The title compound, C(24)H(20)N(2)OS, crystallizes with two independent mol­ecules (A and B) in the asymmetric unit, in each of which the cyclo­hexene rings adopt half-chair conformations. The mean plane of the indole ring is twisted from those of the phenyl and thio­phene rings by 69.0 (7) and 8.3 (5)°, respectively, in mol­ecule A and by 65.4 (9) and 6.7 (5)°, respectively, in mol­ecule B. The dihedral angles between the mean planes of the phenyl and thio­phene rings are 63.0 (4) and 58.8 (9)° in mol­ecules A and B, respectively. In the crystal, N—H⋯O hydrogen bonds lead to the formation of an infinite chain along [101]. In addition, π–π stacking inter­actions are observed involving the thio­phene and pyrrole rings of the two mol­ecules, with a shortest inter­centroid distance of 3.468 (2) Å.
format Online
Article
Text
id pubmed-3998588
institution National Center for Biotechnology Information
language English
publishDate 2014
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-39985882014-05-13 {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone Kaur, Manpreet Jasinski, Jerry P. Yamuna, Thammarse S. Yathirajan, H. S. Byrappa, K. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(24)H(20)N(2)OS, crystallizes with two independent mol­ecules (A and B) in the asymmetric unit, in each of which the cyclo­hexene rings adopt half-chair conformations. The mean plane of the indole ring is twisted from those of the phenyl and thio­phene rings by 69.0 (7) and 8.3 (5)°, respectively, in mol­ecule A and by 65.4 (9) and 6.7 (5)°, respectively, in mol­ecule B. The dihedral angles between the mean planes of the phenyl and thio­phene rings are 63.0 (4) and 58.8 (9)° in mol­ecules A and B, respectively. In the crystal, N—H⋯O hydrogen bonds lead to the formation of an infinite chain along [101]. In addition, π–π stacking inter­actions are observed involving the thio­phene and pyrrole rings of the two mol­ecules, with a shortest inter­centroid distance of 3.468 (2) Å. International Union of Crystallography 2014-03-29 /pmc/articles/PMC3998588/ /pubmed/24826189 http://dx.doi.org/10.1107/S1600536814006345 Text en © Kaur et al. 2014 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
Kaur, Manpreet
Jasinski, Jerry P.
Yamuna, Thammarse S.
Yathirajan, H. S.
Byrappa, K.
{2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title_full {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title_fullStr {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title_full_unstemmed {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title_short {2-[(1H-Indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
title_sort {2-[(1h-indol-3-yl­methyl­idene)amino]-4,5,6,7-tetra­hydro­benzo[b]thio­phen-3-yl}(phen­yl)methanone
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998588/
https://www.ncbi.nlm.nih.gov/pubmed/24826189
http://dx.doi.org/10.1107/S1600536814006345
work_keys_str_mv AT kaurmanpreet 21hindol3ylmethylideneamino4567tetrahydrobenzobthiophen3ylphenylmethanone
AT jasinskijerryp 21hindol3ylmethylideneamino4567tetrahydrobenzobthiophen3ylphenylmethanone
AT yamunathammarses 21hindol3ylmethylideneamino4567tetrahydrobenzobthiophen3ylphenylmethanone
AT yathirajanhs 21hindol3ylmethylideneamino4567tetrahydrobenzobthiophen3ylphenylmethanone
AT byrappak 21hindol3ylmethylideneamino4567tetrahydrobenzobthiophen3ylphenylmethanone