Information card for entry 4304355

Structure parameters

• Formula: C38 H41 N2 Ni P
• Calculated formula: C38 H41 N2 Ni P
• SMILES: [Ni]1([P](C=C(N1c1c(C(C)C)cccc1C(C)C)C)(c1ccccc1)c1ccccc1)([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: 9.517 ± 0.0002 Å
• b: 12.178 ± 0.0002 Å
• c: 15.026 ± 0.0004 Å
• α: 70.647 ± 0.001°
• β: 84.281 ± 0.001°
• γ: 79.506 ± 0.001°
• Cell volume: 1614.15 ± 0.06 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0962
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No