Information card for entry 4501641

Structure parameters

• Formula: C6 H8 N2 O9 Pr
• Calculated formula: C6 H8 N2 O9 Pr
• Title of publication: Lanthanide Contraction and Temperature-Dependent Structures of Lanthanide Coordination Polymers with Imidazole-4,5-Dicarboxylate and Oxalate
• Authors of publication: Lu, Wen-Guan; Jiang, Long; Lu, Tong-Bu
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 4310
• a: 7.4853 ± 0.0013 Å
• b: 17.211 ± 0.003 Å
• c: 8.5448 ± 0.0015 Å
• α: 90°
• β: 110.838 ± 0.003°
• γ: 90°
• Cell volume: 1028.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0411
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No