Information card for entry 4000305

Structure parameters

• Common name: Hexakis(Dibenzoylmethanato)-bis(mu!2$-4,4'-bip
• Chemical name: Hexakis(1,3-Diphenyl-1,3-propanediono)-bis(mu!2$-4,4'-bipyridyl)-tri-zinc(II),
• Formula: C120 H112 N4 O17 S5 Zn3
• Calculated formula: C120 H112 N4 O17 S4.9914 Zn3
• Journal of publication: Chemistry of Materials
• Year of publication: 2003
• a: 12.82 ± 0.001 Å
• b: 13.074 ± 0.001 Å
• c: 18.821 ± 0.003 Å
• α: 72.92 ± 0.01°
• β: 81.78 ± 0.01°
• γ: 62.54 ± 0.01°
• Cell volume: 2675.6 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No