Information card for entry 4503847

Structure parameters

• Formula: C8 H11 Ce O7 P2
• Calculated formula: C8 H11 Ce O7 P2
• Title of publication: Hydro-Ionothermal Synthesis of Lanthanide-Organic Frameworks with 1,4-Phenylenebis(methylene)diphosphonate
• Authors of publication: Shi, Fa-Nian; Trindade, Tito; Rocha, João; Paz, Filipe A. Almeida
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 11
• Pages of publication: 3917
• a: 5.7048 ± 0.0006 Å
• b: 9.5728 ± 0.0009 Å
• c: 11.6025 ± 0.0013 Å
• α: 73.808 ± 0.005°
• β: 80.12 ± 0.005°
• γ: 78.725 ± 0.005°
• Cell volume: 592.12 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0739
• Residual factor for significantly intense reflections: 0.0729
• Weighted residual factors for significantly intense reflections: 0.1881
• Weighted residual factors for all reflections included in the refinement: 0.1887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.238
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No