Information card for entry 2221004

Structure parameters

• Chemical name: Poly[[[μ-1,1'-(butane-1,4-diyl)diimidazole- κ^2^<i>N</i>^3^:<i>N</i>^3'^](μ-cyclohexane-1,4-dicarboxylato- κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^)nickel(II)] 0.25-hydrate]
• Formula: C18 H24.5 N4 Ni O4.25
• Calculated formula: C18 H24.5 N4 Ni O4.25
• Title of publication: Poly[[[μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^](μ-cyclohexane-1,4-dicarboxylato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^)nickel(II)] 0.25-hydrate]
• Authors of publication: Yang, Chun-Hui; Yang, Guang; Du, Zhen-Wu; Lv, Jun-Feng; Yin, Wei-Tian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: m263
• a: 9.0045 ± 0.0009 Å
• b: 11.9991 ± 0.0012 Å
• c: 17.5811 ± 0.0017 Å
• α: 90°
• β: 95.755 ± 0.002°
• γ: 90°
• Cell volume: 1890 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes