Information card for entry 8103243

Structure parameters

• Formula: C25 H18 N2 Ni O8
• Calculated formula: C25 H18 N2 Ni O8
• Title of publication: Crystal structure of catena-aqua(2,2'-bipyridine)-(3-(4-carboxyphenoxy)phthalato)nickel(II), Ni(H2O)(C10H8N2)(C15H8O7)
• Authors of publication: Xiao-Dong Li; Kun Wang; Feng-Feng Guo
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 573
• a: 9.9298 ± 0.0007 Å
• b: 18.0293 ± 0.0013 Å
• c: 24.5124 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4388.4 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0642
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No