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meso-4,4′-Dimethoxy-2,2′-{[(3aR,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-benzimidazole-1,3-diyl]bis(methylene)}diphenol

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ID Minciencias: ART-0000237833-25
Ranking: ART-ART_C

Abstract:

The title compound, C23H30N2O4, a di-Mannich base derived from 4-meth-oxy-phenol and cis-1,2-di-amine-cyclo-hexane, has a perhydro-benzimidazolidine nucleus, in which the cyclo-hexane ring adopts a chair conformation and the heterocyclic ring has a half-chair conformation with a C-N-C-C torsion angles of -48.14 (15) and -14.57 (16)°. The mean plane of the heterocycle makes dihedral angles of 86.29 (6) and 78.92 (6)° with the pendant benzene rings. The mol-ecular structure of the title compound shows the presence of two inter-actions between the N atoms of the imidazolidine ring and the hydroxyl groups through intra-molecular O-H⋯N hydrogen bonds with graph-set motif S(6). The unobserved lone pairs of the N atoms are presumed to be disposed in a syn conformation, being only the second example of an exception to the typical 'rabbit-ears' effect in 1,2-di-amines.

Tópico:

Crystal structures of chemical compounds

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Información de la Fuente:

SCImago Journal & Country Rank
FuenteActa Crystallographica Section E Structure Reports Online
Cuartil año de publicaciónNo disponible
Volumen69
Issue7
Páginaso1057 - o1058
pISSNNo disponible
ISSNNo disponible

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