Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one

The asymmetric unit of the title compound, C(12)H(15)NO, comprises two sym­metry-independent mol­ecules which differ mainly in the conformations of the tert-butyl groups. The mol­ecules contain an essentially planar five-membered 3-pyrroline ring incorporating a carbonyl substituent (pyrrolinone) wh...

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Autores principales: Donkeng Dazie, Joel, Ludvík, Jiří, Fábry, Jan, Eigner, Václav
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5598845/
https://www.ncbi.nlm.nih.gov/pubmed/28932433
http://dx.doi.org/10.1107/S2056989017010337
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author Donkeng Dazie, Joel
Ludvík, Jiří
Fábry, Jan
Eigner, Václav
author_facet Donkeng Dazie, Joel
Ludvík, Jiří
Fábry, Jan
Eigner, Václav
author_sort Donkeng Dazie, Joel
collection PubMed
description The asymmetric unit of the title compound, C(12)H(15)NO, comprises two sym­metry-independent mol­ecules which differ mainly in the conformations of the tert-butyl groups. The mol­ecules contain an essentially planar five-membered 3-pyrroline ring incorporating a carbonyl substituent (pyrrolinone) which forms part of an isoindolinone skeleton. The planarity of the pyrrole ring is compared to other structures with isoindolinone. There are only weak intra- and inter­molecular C—H⋯O and C—H⋯π-electron-ring inter­actions in the crystal structure.
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spelling pubmed-55988452017-09-20 Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one Donkeng Dazie, Joel Ludvík, Jiří Fábry, Jan Eigner, Václav Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, C(12)H(15)NO, comprises two sym­metry-independent mol­ecules which differ mainly in the conformations of the tert-butyl groups. The mol­ecules contain an essentially planar five-membered 3-pyrroline ring incorporating a carbonyl substituent (pyrrolinone) which forms part of an isoindolinone skeleton. The planarity of the pyrrole ring is compared to other structures with isoindolinone. There are only weak intra- and inter­molecular C—H⋯O and C—H⋯π-electron-ring inter­actions in the crystal structure. International Union of Crystallography 2017-07-17 /pmc/articles/PMC5598845/ /pubmed/28932433 http://dx.doi.org/10.1107/S2056989017010337 Text en © Donkeng Dazie et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Donkeng Dazie, Joel
Ludvík, Jiří
Fábry, Jan
Eigner, Václav
Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title_full Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title_fullStr Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title_full_unstemmed Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title_short Crystal structure of 2-tert-butyl-2,3-di­hydro-1H-benzo[c]pyrrol-1-one
title_sort crystal structure of 2-tert-butyl-2,3-di­hydro-1h-benzo[c]pyrrol-1-one
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5598845/
https://www.ncbi.nlm.nih.gov/pubmed/28932433
http://dx.doi.org/10.1107/S2056989017010337
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