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Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate

The title compound, C(23)H(22)N(2)O(4)S, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. They have very similar conformations with the pyrrolidine ring having a twisted conformation, on the C(spiro)—C(spiro) bond, in both mol­ecules. In mol­ecule A, the mean planes of...

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Autores principales: Raja, R., Govindaraj, J., Suresh, M., Raghunathan, R., SubbiahPandi, A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4350727/
https://www.ncbi.nlm.nih.gov/pubmed/25844222
http://dx.doi.org/10.1107/S2056989015001528
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author Raja, R.
Govindaraj, J.
Suresh, M.
Raghunathan, R.
SubbiahPandi, A.
author_facet Raja, R.
Govindaraj, J.
Suresh, M.
Raghunathan, R.
SubbiahPandi, A.
author_sort Raja, R.
collection PubMed
description The title compound, C(23)H(22)N(2)O(4)S, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. They have very similar conformations with the pyrrolidine ring having a twisted conformation, on the C(spiro)—C(spiro) bond, in both mol­ecules. In mol­ecule A, the mean planes of the benzo­thio­phene and indoline ring systems are inclined to the mean plane of the pyrrolidine ring by 87.59 (10) and 84.51 (11)°, respectively, and to one another by 72.69 (7)°. The corresponding angles in mol­ecule B are 87.15 (10), 84.58 (10) and 72.07 (7)°, respectively. In the crystal, the A and B mol­ecules are linked to one another by two N—H⋯O hydrogen bonds, forming a dimer. These dimers are linked via C—H⋯O hydrogen bonds, forming a three-dimensional structure.
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spelling pubmed-43507272015-04-03 Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate Raja, R. Govindaraj, J. Suresh, M. Raghunathan, R. SubbiahPandi, A. Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(23)H(22)N(2)O(4)S, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. They have very similar conformations with the pyrrolidine ring having a twisted conformation, on the C(spiro)—C(spiro) bond, in both mol­ecules. In mol­ecule A, the mean planes of the benzo­thio­phene and indoline ring systems are inclined to the mean plane of the pyrrolidine ring by 87.59 (10) and 84.51 (11)°, respectively, and to one another by 72.69 (7)°. The corresponding angles in mol­ecule B are 87.15 (10), 84.58 (10) and 72.07 (7)°, respectively. In the crystal, the A and B mol­ecules are linked to one another by two N—H⋯O hydrogen bonds, forming a dimer. These dimers are linked via C—H⋯O hydrogen bonds, forming a three-dimensional structure. International Union of Crystallography 2015-02-07 /pmc/articles/PMC4350727/ /pubmed/25844222 http://dx.doi.org/10.1107/S2056989015001528 Text en © Raja et al. 2015 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 Data Reports
Raja, R.
Govindaraj, J.
Suresh, M.
Raghunathan, R.
SubbiahPandi, A.
Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title_full Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title_fullStr Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title_full_unstemmed Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title_short Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
title_sort crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3h-di­spiro­[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxyl­ate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4350727/
https://www.ncbi.nlm.nih.gov/pubmed/25844222
http://dx.doi.org/10.1107/S2056989015001528
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