Information card for entry 7201471

Structure parameters

• Formula: C48 H36 Mn2 N6 O8 S5
• Calculated formula: C48 H36 Mn2 N6 O8 S5
• Title of publication: A novel 3D Mn(II) coordination polymer involving 4,4′-dipyridylsulfide and 4,4′-dipyridyltrisulfide obtained by in situ ligand formation from 4,4′-dipyridyldisulfide
• Authors of publication: Ma, Lu-Fang; Wang, Li-Ya; Du, Miao
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 12
• Pages of publication: 2593
• a: 15.442 ± 0.003 Å
• b: 13.224 ± 0.003 Å
• c: 23.711 ± 0.005 Å
• α: 90°
• β: 107.445 ± 0.002°
• γ: 90°
• Cell volume: 4619.2 ± 1.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0606
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.149
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No