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2,2′-(1,3-Diazinane-1,3-diyl)diacetonitrile: a second monoclinic polymorph
A new monoclinic polymorph of the title compound, C(8)H(12)N(4), in the space group P2(1)/n (Z = 4) is reported. The previously known form was also monoclinic, P2(1) /c (Z = 4), but the unit-cell parameters and crystal packing were different [Shoja & Saba (1993 ▶). Acta Cryst. C49, 354–355]. The...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201474/ https://www.ncbi.nlm.nih.gov/pubmed/22065712 http://dx.doi.org/10.1107/S1600536811038013 |
Sumario: | A new monoclinic polymorph of the title compound, C(8)H(12)N(4), in the space group P2(1)/n (Z = 4) is reported. The previously known form was also monoclinic, P2(1) /c (Z = 4), but the unit-cell parameters and crystal packing were different [Shoja & Saba (1993 ▶). Acta Cryst. C49, 354–355]. The hexahydropyrimidine ring of the title compound adopts a chair conformation with a diequatorial substitution and with the CH(2)-C N groups oriented nearly parallel and in the same direction [NC—CH(2)⋯CH(2)—CN pseudo torsion angle = −6.27 (18)°]. In the crystal, intermolecular C—H⋯ N hydrogen bonds connects the molecules into a chain along the b axis. |
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