Information card for entry 2221735

Structure parameters

• Chemical name: Poly[[diaquabis(μ~2~-4,4'-bipyridine)manganese(II)] bis[2-(2-carboxyphenyldisulfanyl)benzoate]]
• Formula: C48 H38 Mn N4 O10 S4
• Calculated formula: C48 H38 Mn N4 O10 S4
• Title of publication: Poly[[diaquabis(μ~2~-4,4'-bipyridine)manganese(II)] bis[2-(2-carboxyphenyldisulfanyl)benzoate]]
• Authors of publication: Hu, Min; Ma, Song-Tao; Guo, Liang-Qi; Fang, Shao-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m538 - m539
• a: 8.26 ± 0.005 Å
• b: 11.771 ± 0.007 Å
• c: 11.917 ± 0.007 Å
• α: 94.334 ± 0.006°
• β: 102.339 ± 0.007°
• γ: 96.217 ± 0.007°
• Cell volume: 1119.4 ± 1.2 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: 0.0421
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes