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2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one

The crystal structure of the title compound, C(25)H(31)NO(3), exists in a twin-chair conformation with an equatorial orientation of the ortho-eth­oxy­phenyl groups. According to Cremer and Pople [Cremer & Pople (1975 ▶), J. Am. Chem. Soc. 97, 1354–1358], both the piperidone and cyclo­hexa­none r...

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Detalles Bibliográficos
Autores principales: Parthiban, P., Ramkumar, V., Park, Dong Ho, Jeong, Yeon Tae
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120546/
https://www.ncbi.nlm.nih.gov/pubmed/21754845
http://dx.doi.org/10.1107/S1600536811018472
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author Parthiban, P.
Ramkumar, V.
Park, Dong Ho
Jeong, Yeon Tae
author_facet Parthiban, P.
Ramkumar, V.
Park, Dong Ho
Jeong, Yeon Tae
author_sort Parthiban, P.
collection PubMed
description The crystal structure of the title compound, C(25)H(31)NO(3), exists in a twin-chair conformation with an equatorial orientation of the ortho-eth­oxy­phenyl groups. According to Cremer and Pople [Cremer & Pople (1975 ▶), J. Am. Chem. Soc. 97, 1354–1358], both the piperidone and cyclo­hexa­none rings are significantly puckered with total puckering amplitutdes Q (T) of 0.5889 (18) and 0.554 (2) Å, respectively. The ortho-eth­oxy­phenyl groups are located on either side of the secondary amino group and make a dihedral angle of 12.41 (4)° with respect to each other. The methyl group on the cyclo­hexa­none part occupies an exocyclic equatorial disposition. The crystal packing is stabilized by weak van der Waals inter­actions.
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spelling pubmed-31205462011-07-13 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one Parthiban, P. Ramkumar, V. Park, Dong Ho Jeong, Yeon Tae Acta Crystallogr Sect E Struct Rep Online Organic Papers The crystal structure of the title compound, C(25)H(31)NO(3), exists in a twin-chair conformation with an equatorial orientation of the ortho-eth­oxy­phenyl groups. According to Cremer and Pople [Cremer & Pople (1975 ▶), J. Am. Chem. Soc. 97, 1354–1358], both the piperidone and cyclo­hexa­none rings are significantly puckered with total puckering amplitutdes Q (T) of 0.5889 (18) and 0.554 (2) Å, respectively. The ortho-eth­oxy­phenyl groups are located on either side of the secondary amino group and make a dihedral angle of 12.41 (4)° with respect to each other. The methyl group on the cyclo­hexa­none part occupies an exocyclic equatorial disposition. The crystal packing is stabilized by weak van der Waals inter­actions. International Union of Crystallography 2011-05-20 /pmc/articles/PMC3120546/ /pubmed/21754845 http://dx.doi.org/10.1107/S1600536811018472 Text en © Parthiban et al. 2011 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
Parthiban, P.
Ramkumar, V.
Park, Dong Ho
Jeong, Yeon Tae
2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title_full 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title_fullStr 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title_full_unstemmed 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title_short 2,4-Bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
title_sort 2,4-bis(2-eth­oxy­phen­yl)-7-methyl-3-aza­bicyclo­[3.3.1]nonan-9-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120546/
https://www.ncbi.nlm.nih.gov/pubmed/21754845
http://dx.doi.org/10.1107/S1600536811018472
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