Cargando…
1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine
In the title compound, C(24)H(25)ClN(2), the methine, methylene and methyl C atoms of the methyl-substituted imidazolidine ring are disordered over two sets of sites with a refined occupancy ratio of 0.834 (4):0.166 (4). Each disordered ring assumes an envelope conformation with an N atom as the fl...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3589010/ https://www.ncbi.nlm.nih.gov/pubmed/23476246 http://dx.doi.org/10.1107/S1600536812047575 |
_version_ | 1782261676999966720 |
---|---|
author | Rivera, Augusto Cardenas, Lorena Ríos-Motta, Jaime Eigner, Václav Dušek, Michal |
author_facet | Rivera, Augusto Cardenas, Lorena Ríos-Motta, Jaime Eigner, Václav Dušek, Michal |
author_sort | Rivera, Augusto |
collection | PubMed |
description | In the title compound, C(24)H(25)ClN(2), the methine, methylene and methyl C atoms of the methyl-substituted imidazolidine ring are disordered over two sets of sites with a refined occupancy ratio of 0.834 (4):0.166 (4). Each disordered ring assumes an envelope conformation with an N atom as the flap. The pendant benzyl rings are oriented equatorially with respect to the imidazolidine ring. The chlorophenyl ring is inclined to the mean plane of the four planar atoms of the major component of the imidazolidine ring by 76.27 (12)°. The dihedral angles between the chlorophenyl ring and the two benzyl rings are 55.31 (9) and 57.50 (8)°; the dihedral angle between these latter rings is 71.59 (9)°. In the crystal, molecules are linked by C—H⋯Cl interactions and a number of weak C—H⋯π interactions, involving all three aromatic rings, forming a three-dimensional structure. |
format | Online Article Text |
id | pubmed-3589010 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35890102013-03-08 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine Rivera, Augusto Cardenas, Lorena Ríos-Motta, Jaime Eigner, Václav Dušek, Michal Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(24)H(25)ClN(2), the methine, methylene and methyl C atoms of the methyl-substituted imidazolidine ring are disordered over two sets of sites with a refined occupancy ratio of 0.834 (4):0.166 (4). Each disordered ring assumes an envelope conformation with an N atom as the flap. The pendant benzyl rings are oriented equatorially with respect to the imidazolidine ring. The chlorophenyl ring is inclined to the mean plane of the four planar atoms of the major component of the imidazolidine ring by 76.27 (12)°. The dihedral angles between the chlorophenyl ring and the two benzyl rings are 55.31 (9) and 57.50 (8)°; the dihedral angle between these latter rings is 71.59 (9)°. In the crystal, molecules are linked by C—H⋯Cl interactions and a number of weak C—H⋯π interactions, involving all three aromatic rings, forming a three-dimensional structure. International Union of Crystallography 2012-11-24 /pmc/articles/PMC3589010/ /pubmed/23476246 http://dx.doi.org/10.1107/S1600536812047575 Text en © Rivera et al. 2012 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 Rivera, Augusto Cardenas, Lorena Ríos-Motta, Jaime Eigner, Václav Dušek, Michal 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title | 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title_full | 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title_fullStr | 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title_full_unstemmed | 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title_short | 1,3-Dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
title_sort | 1,3-dibenzyl-2-(2-chlorophenyl)-4-methylimidazolidine |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3589010/ https://www.ncbi.nlm.nih.gov/pubmed/23476246 http://dx.doi.org/10.1107/S1600536812047575 |
work_keys_str_mv | AT riveraaugusto 13dibenzyl22chlorophenyl4methylimidazolidine AT cardenaslorena 13dibenzyl22chlorophenyl4methylimidazolidine AT riosmottajaime 13dibenzyl22chlorophenyl4methylimidazolidine AT eignervaclav 13dibenzyl22chlorophenyl4methylimidazolidine AT dusekmichal 13dibenzyl22chlorophenyl4methylimidazolidine |