1,3-Bis(4-tert-butyl­benz­yl)-4,5-dihydro­imidazolium chloride monohydrate

In the title compound, C(25)H(35)N(2) (+)·Cl(−)·H(2)O, the imidazolidine ring adopts a twisted conformation, with a pseudo-twofold axis passing through the N—C—N carbon and the opposite C—C bond. The N—C—N fragment of the imidazolidine ring shows some degree of both double- and single-bond character...

Descripción completa

Detalles Bibliográficos
Autores principales: Arslan, Hakan, VanDerveer, Don, Yaşar, Sedat, Özdemir, İsmail, Çetinkaya, Bekir
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968238/
https://www.ncbi.nlm.nih.gov/pubmed/21581919
http://dx.doi.org/10.1107/S1600536809000452
Descripción
Sumario:In the title compound, C(25)H(35)N(2) (+)·Cl(−)·H(2)O, the imidazolidine ring adopts a twisted conformation, with a pseudo-twofold axis passing through the N—C—N carbon and the opposite C—C bond. The N—C—N fragment of the imidazolidine ring shows some degree of both double- and single-bond character due to partial electron delocalization. One of the tert-butyl groups is disordered over two conformations with occupancies of 0.714 (8) and 0.286 (8). In the crystal, O—H⋯Cl and C—H⋯O hydrogen bonds help to establish the packing.

Ejemplares similares