Information card for entry 7109102

Structure parameters

• Formula: C16.25 H26.67 Cd N7.04 O2.6
• Calculated formula: C10 H10 Cd N6
• Title of publication: Gyroidal metal-organic frameworks by solvothermal subcomponent self-assembly
• Authors of publication: Yuan Wu; Xiao-Ping Zhou; Ju-Rong Yang; Dan Li
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 3413
• a: 37.8124 ± 0.0001 Å
• b: 37.8124 ± 0.0001 Å
• c: 37.8124 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 54063.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 230
• Hermann-Mauguin space group symbol: I a -3 d
• Hall space group symbol: -I 4bd 2c 3
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No