Information card for entry 8106803

Structure parameters

• Formula: C28 H30 F4 N2 Ni O8
• Calculated formula: C28 H30 F4 N2 Ni O8
• Title of publication: Crystal structure of catenapoly[diaqua-(μ 24,4′-bipyridine)-κ 2 N:N′)-bis(2,6-difluorobenzoate)-κO)nickel(II)] ethanol monosolvate, C28H30F4N2O8Ni
• Authors of publication: Hou-Qun, Yuan; Wei, Xiao; Chun-Yan, Hu; Guang-Ming, Bao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 1
• Pages of publication: 125 - 127
• a: 10.164 ± 0.007 Å
• b: 13.927 ± 0.009 Å
• c: 11.409 ± 0.008 Å
• α: 90°
• β: 111.863 ± 0.01°
• γ: 90°
• Cell volume: 1498.8 ± 1.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No