2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol

The conformation of the title compound, C(27)H(34)O, is stabilized by a weak intra­molecular C—H⋯π inter­action. The dihedral angle between the benzene rings is 54.79 (4)°. The adamantane cage consists of three fused cyclo­hexane rings in classical chair conformations, with C—C—C angles in the range...

Descripción completa

Detalles Bibliográficos
Autores principales: Babjaková, Eva, Bartoš, Peter, Vícha, Robert
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588353/
https://www.ncbi.nlm.nih.gov/pubmed/23476370
http://dx.doi.org/10.1107/S1600536812050647
_version_ 1782261546291822592
author Babjaková, Eva
Bartoš, Peter
Vícha, Robert
author_facet Babjaková, Eva
Bartoš, Peter
Vícha, Robert
author_sort Babjaková, Eva
collection PubMed
description The conformation of the title compound, C(27)H(34)O, is stabilized by a weak intra­molecular C—H⋯π inter­action. The dihedral angle between the benzene rings is 54.79 (4)°. The adamantane cage consists of three fused cyclo­hexane rings in classical chair conformations, with C—C—C angles in the range 107.75 (10)–111.35 (9)°. Although the mol­ecule contains a hy­droxy group as a conceivable hydrogen-bond donor, this group is sterically hindered by bulky substituents and no hydrogen bonds are observed in the crystal structure.
format Online
Article
Text
id pubmed-3588353
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-35883532013-03-08 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol Babjaková, Eva Bartoš, Peter Vícha, Robert Acta Crystallogr Sect E Struct Rep Online Organic Papers The conformation of the title compound, C(27)H(34)O, is stabilized by a weak intra­molecular C—H⋯π inter­action. The dihedral angle between the benzene rings is 54.79 (4)°. The adamantane cage consists of three fused cyclo­hexane rings in classical chair conformations, with C—C—C angles in the range 107.75 (10)–111.35 (9)°. Although the mol­ecule contains a hy­droxy group as a conceivable hydrogen-bond donor, this group is sterically hindered by bulky substituents and no hydrogen bonds are observed in the crystal structure. International Union of Crystallography 2012-12-19 /pmc/articles/PMC3588353/ /pubmed/23476370 http://dx.doi.org/10.1107/S1600536812050647 Text en © Babjaková et al. 2013 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
Babjaková, Eva
Bartoš, Peter
Vícha, Robert
2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title_full 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title_fullStr 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title_full_unstemmed 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title_short 2-(Adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
title_sort 2-(adamantan-1-yl)-1,3-bis­(4-methyl­phen­yl)propan-2-ol
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588353/
https://www.ncbi.nlm.nih.gov/pubmed/23476370
http://dx.doi.org/10.1107/S1600536812050647
work_keys_str_mv AT babjakovaeva 2adamantan1yl13bis4methylphenylpropan2ol
AT bartospeter 2adamantan1yl13bis4methylphenylpropan2ol
AT vicharobert 2adamantan1yl13bis4methylphenylpropan2ol

Ejemplares similares