Information card for entry 4000337

Structure parameters

• Common name: Catena-(bis(Dibenzoylmethanato)-(mu!2$-4,4'-bi
• Chemical name: Catena-(bis(1,3-Diphenyl-1,3-propanediono)-(mu!2$-4,4'-bipyridyl)-zinc(II)), clathrate with Chlorobenzene (1:2)
• Formula: C52 H40 Cl2 N2 O4 Zn
• Calculated formula: C51.988 H39.99 Cl1.998 N2 O4 Zn
• Journal of publication: Chemistry of Materials
• Year of publication: 2003
• a: 10.711 ± 0.002 Å
• b: 19.313 ± 0.003 Å
• c: 21.58 ± 0.003 Å
• α: 90°
• β: 97.01 ± 0.01°
• γ: 90°
• Cell volume: 4431 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0461
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No