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1,3-Dibenzyl-2-(2-chloro-phen-yl)-4-methyl-imidazolidine.

ABSTRACT: In the title compound, C24H25ClN2, the methine, methyl-ene 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 chloro-phenyl 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 chloro-phenyl 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, mol-ecules are linked by C-H?Cl inter-actions and a number of weak C-H?? inter-actions, involving all three aromatic rings, forming a three-dimensional structure.

SUBMITTER: Rivera A

PROVIDER: S-EPMC3589010 | biostudies-literature | 2012 Dec

REPOSITORIES: biostudies-literature

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1,3-Dibenzyl-2-(2-chloro-phen-yl)-4-methyl-imidazolidine.

Rivera Augusto A Cardenas Lorena L Ríos-Motta Jaime J Eigner Václav V Dušek Michal M

Acta crystallographica. Section E, Structure reports online 20121124 Pt 12

In the title compound, C24H25ClN2, the methine, methyl-ene 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 chloro-phenyl ring is inclined to the mean plane of the four planar atoms of the major component of the imi ...[more]

PMID: 23476246

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