Information card for entry 4500279

Structure parameters

• Formula: C44 H32 Ce5 N7 O35 S2
• Calculated formula: C44 H32 Ce5 N7 O35 S2
• Title of publication: A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate
• Authors of publication: Xu, Jing; Su, Weiping; Hong, Maochun
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 1
• Pages of publication: 337
• a: 10.701 ± 0.007 Å
• b: 10.737 ± 0.007 Å
• c: 27.233 ± 0.017 Å
• α: 95.068 ± 0.008°
• β: 101.078 ± 0.005°
• γ: 103.937 ± 0.009°
• Cell volume: 2950 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1047
• Residual factor for significantly intense reflections: 0.0757
• Weighted residual factors for significantly intense reflections: 0.1974
• Weighted residual factors for all reflections included in the refinement: 0.2287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No