Information card for entry 4000099

Structure parameters

• Common name: Bis(dibenzoylmethanato)bis(2-methylpyridine)ni
• Chemical name: Bis(1,3-diphenyl-1,3-propanediono)bis(2-methylpyridine)nickel(II), clathrate wi
• Formula: C50 H44 N2 Ni O4
• Calculated formula: C50 H44 N2 Ni O4
• Journal of publication: Chemistry of Materials
• Year of publication: 2001
• a: 11.765 ± 0.002 Å
• b: 12.861 ± 0.002 Å
• c: 21.378 ± 0.003 Å
• α: 98.92 ± 0.01°
• β: 99.23 ± 0.01°
• γ: 100.29 ± 0.01°
• Cell volume: 3084.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0918
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 0.877
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No