Information card for entry 2211626

Structure parameters

• Chemical name: Tetraaqua-(1,10-phenanthroline-5,6-dione-N,<i>N</i>')manganese(II) sulfate hydrate
• Formula: C12 H18 Mn N2 O12 S
• Calculated formula: C12 H18 Mn N2 O12 S
• Title of publication: Tetraaqua(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')manganese(II) sulfate dihydrate
• Authors of publication: Wang, Xiao-Xia; Sun, Feng; Zhan, Qing-Guang; Wu, Jian-Zhong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3380 - m3382
• a: 9.6237 ± 0.0004 Å
• b: 13.9117 ± 0.0006 Å
• c: 13.8744 ± 0.0006 Å
• α: 90°
• β: 97.317 ± 0.003°
• γ: 90°
• Cell volume: 1842.41 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0464
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes