Information card for entry 2215760

Structure parameters

• Chemical name: Diaquabis(5-<i>n</i>-butylpyridine-2-carboxylato-\ κ^2^<i>N</i>,<i>O</i>)nickel(II) dihydrate
• Formula: C20 H32 N2 Ni O8
• Calculated formula: C20 H32 N2 Ni O8
• Title of publication: Diaquabis(5-<i>n</i>-butylpyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)nickel(II) dihydrate
• Authors of publication: Liang Qin; Hai-Fu Guo; Xiang Li; De-Yun Ma; Wen-Dong Song
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2853 - m2853
• a: 5.2217 ± 0.001 Å
• b: 9.9614 ± 0.0017 Å
• c: 11.507 ± 0.0019 Å
• α: 79.378 ± 0.003°
• β: 79.191 ± 0.003°
• γ: 80.152 ± 0.003°
• Cell volume: 572.05 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0514
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes