1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one

In the title compound, C(18)H(19)BrN(2)O, the seven-membered azepine ring adopts a twist-boat conformation: the bond angles about the azepine N atom are indicative of sp (2) hybridization. The dihedral angle between the plane of the carbon–carbon double bond of the enone unit and the mean plane of t...

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Detalles Bibliográficos
Autores principales: Helliwell, Madeleine, Aghazadeh, Masomeh, Baradarani, Mehdi M., Joule, John A.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007022/
https://www.ncbi.nlm.nih.gov/pubmed/21587781
http://dx.doi.org/10.1107/S1600536810019975
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author Helliwell, Madeleine
Aghazadeh, Masomeh
Baradarani, Mehdi M.
Joule, John A.
author_facet Helliwell, Madeleine
Aghazadeh, Masomeh
Baradarani, Mehdi M.
Joule, John A.
author_sort Helliwell, Madeleine
collection PubMed
description In the title compound, C(18)H(19)BrN(2)O, the seven-membered azepine ring adopts a twist-boat conformation: the bond angles about the azepine N atom are indicative of sp (2) hybridization. The dihedral angle between the plane of the carbon–carbon double bond of the enone unit and the mean plane of the indole ring is 27.8 (1)°. In the crystal, an N—H⋯O hydrogen bond links the mol­ecules into chains along the b axis.
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spelling pubmed-30070222010-12-30 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one Helliwell, Madeleine Aghazadeh, Masomeh Baradarani, Mehdi M. Joule, John A. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(18)H(19)BrN(2)O, the seven-membered azepine ring adopts a twist-boat conformation: the bond angles about the azepine N atom are indicative of sp (2) hybridization. The dihedral angle between the plane of the carbon–carbon double bond of the enone unit and the mean plane of the indole ring is 27.8 (1)°. In the crystal, an N—H⋯O hydrogen bond links the mol­ecules into chains along the b axis. International Union of Crystallography 2010-06-05 /pmc/articles/PMC3007022/ /pubmed/21587781 http://dx.doi.org/10.1107/S1600536810019975 Text en © Helliwell et al. 2010 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
Helliwell, Madeleine
Aghazadeh, Masomeh
Baradarani, Mehdi M.
Joule, John A.
1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title_full 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title_fullStr 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title_full_unstemmed 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title_short 1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1H-azepin-2-yl­idene]propan-2-one
title_sort 1-[(e)-4-(5-bromo-1h-indol-3-yl)-1-methyl-2,5,6,7-tetra­hydro-1h-azepin-2-yl­idene]propan-2-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007022/
https://www.ncbi.nlm.nih.gov/pubmed/21587781
http://dx.doi.org/10.1107/S1600536810019975
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AT baradaranimehdim 1e45bromo1hindol3yl1methyl2567tetrahydro1hazepin2ylidenepropan2one
AT joulejohna 1e45bromo1hindol3yl1methyl2567tetrahydro1hazepin2ylidenepropan2one

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