Information card for entry 2210610

Structure parameters

• Chemical name: Diaquabis(4-formylbenzoato-κO)bis(1H-imidazole-κN^3^)nickel(II)
• Formula: C22 H22 N4 Ni O8
• Calculated formula: C22 H22 N4 Ni O8
• Title of publication: Diaquabis(4-formylbenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)
• Authors of publication: Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: m2422 - m2423
• a: 5.6143 ± 0.0002 Å
• b: 8.0757 ± 0.0004 Å
• c: 12.8208 ± 0.0005 Å
• α: 73.995 ± 0.001°
• β: 86.114 ± 0.001°
• γ: 87.038 ± 0.001°
• Cell volume: 557.14 ± 0.04 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.035
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.089
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes