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4-Amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide–1,4-diazabicyclo[2.2.2]octane (2/1)
The asymmetric unit of the title co-crystal, C(12)H(14)N(4)O(2)S·0.5C(6)H(12)N(2), comprises the sulfonamide molecule and half a molecule of 1,4-diazabicyclo[2.2.2]octane (DABCO), the latter being disposed about a crystallographic twofold rotation axis. In the sulfonamide molecule, the aromati...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884290/ https://www.ncbi.nlm.nih.gov/pubmed/24454066 http://dx.doi.org/10.1107/S1600536813027037 |
Sumario: | The asymmetric unit of the title co-crystal, C(12)H(14)N(4)O(2)S·0.5C(6)H(12)N(2), comprises the sulfonamide molecule and half a molecule of 1,4-diazabicyclo[2.2.2]octane (DABCO), the latter being disposed about a crystallographic twofold rotation axis. In the sulfonamide molecule, the aromatic rings are almost perpendicular to one another [dihedral angle = 75.01 (8)°]. In the crystal, molecules are connected into a three-molecule aggregate via amide–DABCO N—H⋯N hydrogen bonds, and these are connected into a three-dimensional architecture via amino–DABCO N—H⋯O and amino-pyrimidine N—H⋯N hydrogen bonds. |
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