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2-[(1-{[3-(dimethylazaniumyl)propyl]methylamino}ethylidene)azaniumyl]­nona­hydro-closo-deca­borate dimethyl sulfoxide disolvate

The title compound, 2-B(10)H(9)NH=C(CH(3))N(CH(3))CH(2)CH(2)CH(2)N(CH(3))(2)H·2C(2)H(6)OS or C(8)H(29)B(10)N(3)·2C(2)H(6)OS, is zwitterionic with the negative charge localized on the deca­borate cage and the positive charge on the terminal ammonium group. Two mol­ecules of dimethyl sulfoxide (DMSO)...

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Detalles Bibliográficos
Autores principales: Getman, Thomas D., Luck, Rudy L., Cienkus, Caitlin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3151893/
https://www.ncbi.nlm.nih.gov/pubmed/21837080
http://dx.doi.org/10.1107/S1600536811020186
Descripción
Sumario:The title compound, 2-B(10)H(9)NH=C(CH(3))N(CH(3))CH(2)CH(2)CH(2)N(CH(3))(2)H·2C(2)H(6)OS or C(8)H(29)B(10)N(3)·2C(2)H(6)OS, is zwitterionic with the negative charge localized on the deca­borate cage and the positive charge on the terminal ammonium group. Two mol­ecules of dimethyl sulfoxide (DMSO) and one mol­ecule of the title compound constitute the asymmetric unit. One DMSO mol­ecule is disordered [ratio 0.739 (3):0.261 (3)]. The bonds and angles within the deca­borate cage are within the normal ranges. The amidine fragment of the ligand, which is expected to be planar, is significantly distorted from planarity as exemplified by four torsion angles [B—N—C—C = 8.4 (3), H—N—C—N = 5(2), N—C—N—C = 7.3 (3) and C—C—N—C = 14.8 (3)°] found within this portion of the mol­ecule. The crystal packing consists of head-to-tail-arranged dimers of the title mol­ecule held together by four mol­ecules of DMSO which are attached via strong N—H⋯O and weak C—H⋯O hydrogen bonds.