Information card for entry 8103176

Structure parameters

• Chemical name: (μ~2~-2,2'-Bipyrimidine)-octaaquadimanganese(II) bis(sulfate) dihydrate
• Formula: C8 H26 Mn2 N4 O18 S2
• Calculated formula: C8 H26 Mn2 N4 O18 S2
• Title of publication: Crystal structure of octaaqua(?2-2,2'-bipyrimidine)dimanganese(II) bis(sulfate) — water (1:2), [Mn2(H2O)8(C8H6N4)][(SO4)2] · 2H2O
• Authors of publication: Kwang Ha
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 3
• Pages of publication: 313
• a: 8.1522 ± 0.0005 Å
• b: 11.6765 ± 0.0007 Å
• c: 11.9942 ± 0.0007 Å
• α: 90°
• β: 91.667 ± 0.001°
• γ: 90°
• Cell volume: 1141.23 ± 0.12 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0583
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.1041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No