Information card for entry 2008763

Structure parameters

• Chemical name: Tetraaqua(1,10-Phenanthroline)Nickel(II) Dinitrate Monohydrate
• Formula: C12 H18 N4 Ni O11
• Calculated formula: C12 H18 N4 Ni O11
• SMILES: [Ni]1([OH2])([OH2])([OH2])([OH2])[n]2c3c4[n]1cccc4ccc3ccc2.O=N(=O)[O-].O=N(=O)[O-].O
• Title of publication: Tetraaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>)nickel(II) dinitrate monohydrate
• Authors of publication: Namouchi Cherni, Saoussen; Driss, Ahmed; Jouini, Tahar
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 1248 - 1250
• a: 8.783 ± 0.001 Å
• b: 13.629 ± 0.002 Å
• c: 15.411 ± 0.002 Å
• α: 90°
• β: 94.71 ± 0.01°
• γ: 90°
• Cell volume: 1838.5 ± 0.4 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: 0.0499
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for all reflections: 0.0877
• Weighted residual factors for significantly intense reflections: 0.08
• Goodness-of-fit parameter for all reflections: 1.053
• Goodness-of-fit parameter for significantly intense reflections: 1.091
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No