3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K

In the title compound, C(15)H(18)ClNO(3), the seven-membered ring has a mirror plane passing through the methyl­ene C atom and bis­ecting the C=C bond. It adopts a bent conformation, inter­mediate between the boat and chair forms. Both meth­oxy groups are coplanar with the attached benzene ring [C—C...

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Autor principal: Cheng, Xiang-Wei
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961294/
https://www.ncbi.nlm.nih.gov/pubmed/21202388
http://dx.doi.org/10.1107/S1600536808011264
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author Cheng, Xiang-Wei
author_facet Cheng, Xiang-Wei
author_sort Cheng, Xiang-Wei
collection PubMed
description In the title compound, C(15)H(18)ClNO(3), the seven-membered ring has a mirror plane passing through the methyl­ene C atom and bis­ecting the C=C bond. It adopts a bent conformation, inter­mediate between the boat and chair forms. Both meth­oxy groups are coplanar with the attached benzene ring [C—C—O—C = −0.5 (3) and 2.2 (3)°]. In the crystal structure, inversion-related mol­ecules are linked via C—H⋯O hydrogen bonds and π–π inter­actions involving the benzene ring [centroid–centroid distance = 3.6393 (12)Å].
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spelling pubmed-29612942010-12-30 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K Cheng, Xiang-Wei Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(18)ClNO(3), the seven-membered ring has a mirror plane passing through the methyl­ene C atom and bis­ecting the C=C bond. It adopts a bent conformation, inter­mediate between the boat and chair forms. Both meth­oxy groups are coplanar with the attached benzene ring [C—C—O—C = −0.5 (3) and 2.2 (3)°]. In the crystal structure, inversion-related mol­ecules are linked via C—H⋯O hydrogen bonds and π–π inter­actions involving the benzene ring [centroid–centroid distance = 3.6393 (12)Å]. International Union of Crystallography 2008-04-26 /pmc/articles/PMC2961294/ /pubmed/21202388 http://dx.doi.org/10.1107/S1600536808011264 Text en © Xiang-Wei Cheng 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
Cheng, Xiang-Wei
3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title_full 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title_fullStr 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title_full_unstemmed 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title_short 3-(3-Chloro­prop­yl)-7,8-dimeth­oxy-1H-3-benzazepin-2(3H)-one at 125 K
title_sort 3-(3-chloro­prop­yl)-7,8-dimeth­oxy-1h-3-benzazepin-2(3h)-one at 125 k
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961294/
https://www.ncbi.nlm.nih.gov/pubmed/21202388
http://dx.doi.org/10.1107/S1600536808011264
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