Information card for entry 2208768

Structure parameters

• Chemical name: [Trisaqua(2,2^'^-bipyridine)maleatonickel(II)] hydrate
• Formula: C14 H18 N2 Ni O8
• Calculated formula: C14 H18 N2 Ni O8
• SMILES: [Ni]1([n]2c(c3[n]1cccc3)cccc2)(OC(=O)/C=C/C(=O)[O-])([OH2])([OH2])[OH2].O
• Title of publication: Triaqua(2,2'-bipyridine)maleatonickel(II) monohydrate
• Authors of publication: Mingtian Li; Xucheng Fu; Chenggang Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m865 - m866
• a: 9.4941 ± 0.0019 Å
• b: 7.6031 ± 0.0015 Å
• c: 23.408 ± 0.005 Å
• α: 90°
• β: 97.73 ± 0.03°
• γ: 90°
• Cell volume: 1674.3 ± 0.6 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 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: 0.064
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.132
• Weighted residual factors for all reflections included in the refinement: 0.141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes