Information card for entry 8107081

Structure parameters

• Formula: C18 H22 N4 Ni O4
• Calculated formula: C18 H22 N4 Ni O4
• Title of publication: Crystal structure of poly-{[μ2-(E)-1,4-di(1H-imidazol-1-yl)but-2-ene-κ2 N:N′][μ2-cyclohexane-1,4-dicarboxylato-κ4 O,O′:O′′,O′′′]nickel(II)}, C18H22N4NiO4
• Authors of publication: Li, Wei; Sun, Xuan; Suo, Jian; Xing, Yanpeng; Wang, Daguang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1015 - 1016
• a: 8.9924 ± 0.0005 Å
• b: 17.1818 ± 0.001 Å
• c: 12.1009 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1869.66 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.04
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No