Information card for entry 4000097

Structure parameters

• Common name: Bis(dibenzoylmethanato)bis(2-methylpyridine)ni
• Chemical name: Bis(1,3-diphenyl-1,3-propanediono)bis(2-methylpyridine)nickel(II), stable form
• Formula: C42 H36 N2 Ni O4
• Calculated formula: C42 H36 N2 Ni O4
• Journal of publication: Chemistry of Materials
• Year of publication: 2001
• a: 11.302 ± 0.002 Å
• b: 12.505 ± 0.002 Å
• c: 13.007 ± 0.002 Å
• α: 80.78 ± 0.01°
• β: 76.67 ± 0.01°
• γ: 86.51 ± 0.01°
• Cell volume: 1765.1 ± 0.5 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: 0.0595
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.118
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No