Information card for entry 4503308

Structure parameters

• Formula: C55 H48 Cd5 N16 O23
• Calculated formula: C55 H38 Cd5 N16 O23
• Title of publication: Four 3D Porous Metal−Organic Frameworks with Various Layered and Pillared Motifs
• Authors of publication: Lu, Wen-Guan; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 3
• Pages of publication: 986
• a: 19.041 ± 0.004 Å
• b: 23.089 ± 0.005 Å
• c: 15.056 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6619 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 67
• Hermann-Mauguin space group symbol: C m m a
• Hall space group symbol: -C 2a 2
• Residual factor for all reflections: 0.1157
• Residual factor for significantly intense reflections: 0.0954
• Weighted residual factors for significantly intense reflections: 0.2002
• Weighted residual factors for all reflections included in the refinement: 0.2113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No