Information card for entry 8106516

Structure parameters

• Formula: C42 H40 Cl2 Co N6 O10 S2
• Calculated formula: C42 H40 Cl2 Co N6 O10 S2
• Title of publication: Crystal structure of poly-[diaqua-bis(μ-4,4′-bipyridine-κ2 N:N′)cobalt(II)] bis(4-chlorobenzenesulfonate) – 4,4′-bipyridine – water (1/1/2), C42H40Cl2CoN6O10S2
• Authors of publication: Liu, Zheng-Jun; Chen, Xiao-Miao; Deng, Tao-Li
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 2
• Pages of publication: 297 - 299
• a: 17.447 ± 0.006 Å
• b: 11.467 ± 0.004 Å
• c: 22.691 ± 0.004 Å
• α: 90°
• β: 108.314 ± 0.005°
• γ: 90°
• Cell volume: 4310 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0453
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No