Information card for entry 2224504

Structure parameters

• Chemical name: Hexaaquamanganese(II) tetraaquabis(2-aminopyrazine-κ<i>N</i>^4^)manganese(II) disulfate dihydrate
• Formula: C8 H34 Mn2 N6 O20 S2
• Calculated formula: C8 H34 Mn2 N6 O20 S2
• SMILES: O=S(=O)([O-])[O-].[Mn]([n]1cc(ncc1)N)([n]1cc(ncc1)N)([OH2])([OH2])([OH2])[OH2].[Mn]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].O.[O-]S(=O)(=O)[O-].O
• Title of publication: Hexaaquamanganese(II) tetraaquabis(2-aminopyrazine-κ<i>N</i>^4^)manganese(II) disulfate dihydrate
• Authors of publication: Huo, Li-Hua; Gao, Shan; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1504
• a: 6.6242 ± 0.0003 Å
• b: 8.4639 ± 0.0004 Å
• c: 13.2719 ± 0.0008 Å
• α: 75.654 ± 0.002°
• β: 78.364 ± 0.002°
• γ: 78.834 ± 0.002°
• Cell volume: 697.95 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1272
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes