Information card for entry 4320241

Structure parameters

• Formula: C31 H48 N2 Ni O P4
• Calculated formula: C32 H40 N2 Ni P4
• Title of publication: Separating the Racemic and Meso Diastereomers of a Binucleating Tetraphosphine Ligand System through the Use of Nickel Chloride
• Authors of publication: David A. Aubry; Scott A. Laneman; Frank R. Fronczek; George G. Stanley
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 5036 - 5041
• a: 15.128 ± 0.002 Å
• b: 11.085 ± 0.002 Å
• c: 20.663 ± 0.002 Å
• α: 90°
• β: 98.78 ± 0.02°
• γ: 90°
• Cell volume: 3424.5 ± 0.9 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• 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: 0.063
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for all reflections: 0.109
• Weighted residual factors for significantly intense reflections: 0.084
• Goodness-of-fit parameter for all reflections: 0.608
• Goodness-of-fit parameter for significantly intense reflections: 1.737
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: Cu-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No