Information card for entry 8106335

Structure parameters

• Formula: C156 H140 Mn8 N36 O60 S8
• Calculated formula: C156 H140 Mn8 N36 O60 S8
• Title of publication: Crystal structure of poly-{diaqua-bis[(μ2-3-nitrobenzenesulfonylglycine-κ3 N:O:O′)(4,4′-bipyridine)manganese(II)]}-dimethylformamide (1/1), C39H35Mn2N9O15S2
• Authors of publication: Chen, Xiao-Miao; Liu, Zheng-Jun; Deng, Tao-Li
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 5
• Pages of publication: 893 - 895
• a: 17.2427 ± 0.0006 Å
• b: 11.7453 ± 0.0003 Å
• c: 21.1828 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4290 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No