Information card for entry 4304357

Structure parameters

• Formula: C32 H29 N2 Ni P
• Calculated formula: C32 H29 N2 Ni P
• SMILES: [Ni]1([P](c2ccccc2)(c2ccccc2)C=C(N1c1ccccc1)C)([n]1ccccc1)c1ccccc1
• Title of publication: Nickel(II) Complexes Containing Bidentate Amido Phosphine Ligands Derived from α-Iminophosphorus Ylides: Synthesis and Structural Characterization
• Authors of publication: Pei-Ying Lee; Lan-Chang Liang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 749 - 758
• a: 10.238 ± 0.0004 Å
• b: 9.748 ± 0.0005 Å
• c: 26.779 ± 0.0014 Å
• α: 90°
• β: 91.737 ± 0.002°
• γ: 90°
• Cell volume: 2671.3 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1099
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1372
• Weighted residual factors for all reflections included in the refinement: 0.1619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No