Information card for entry 2238447

Structure parameters

• Chemical name: Bis(2,4,6-triaminopyrimidin-1-ium) sulfate pentahydrate
• Formula: C8 H26 N10 O9 S
• Calculated formula: C8 H26 N10 O9 S
• Title of publication: Bis(2,4,6-triaminopyrimidin-1-ium) sulfate pentahydrate
• Authors of publication: Nimthong, Ruthairat; Chamchong, Siva; Pakawatchai, Chaveng; Mokhagul, Jedsada; Wattanakanjana, Yupa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 8
• Pages of publication: o1266 - o1267
• a: 10.6571 ± 0.0007 Å
• b: 13.2482 ± 0.0009 Å
• c: 15.0132 ± 0.001 Å
• α: 100.843 ± 0.002°
• β: 110.596 ± 0.002°
• γ: 92.096 ± 0.002°
• Cell volume: 1936.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.13
• Residual factor for significantly intense reflections: 0.0772
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes