Information card for entry 2219389

Structure parameters

• Chemical name: Poly[[bis(μ~2~-4-aminobenzenesulfonato-κ^2^N:O)diaquamanganese(II)] dihydrate]
• Formula: C12 H20 Mn N2 O10 S2
• Calculated formula: C12 H20 Mn N2 O10 S2
• SMILES: O.[Mn]([NH2]c1ccc(cc1)S(=O)(=O)[O-])([NH2]c1ccc(cc1)S(=O)(=O)[O-])([OH2])[OH2].O
• Title of publication: Poly[[bis(μ~2~-4-aminobenzenesulfonato-κ^2^<i>N</i>:<i>O</i>)diaquamanganese(II)] dihydrate]
• Authors of publication: Li, Zhan Ling; Xuan, Ya Wen; Wu, Wen; Xie, Dong Po
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m1162 - m1163
• a: 7.4485 ± 0.0008 Å
• b: 17.4102 ± 0.0019 Å
• c: 7.6509 ± 0.0009 Å
• α: 90°
• β: 116.688 ± 0.001°
• γ: 90°
• Cell volume: 886.47 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections included in the refinement: 0.1494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes