Information card for entry 4102345

Structure parameters

• Formula: C18 H13 Cd N3 O4
• Calculated formula: C18 H13 Cd N3 O4
• Title of publication: Non-, Micro-, and Mesoporous Metal-Organic Framework Isomers: Reversible Transformation, Fluorescence Sensing, and Large Molecule Separation
• Authors of publication: Hai-Long Jiang; Yoshiro Tatsu; Zhang-Hui Lu; Qiang Xu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 5586 - 5587
• a: 15.95 ± 0.003 Å
• b: 11.7 ± 0.002 Å
• c: 10.21 ± 0.002 Å
• α: 90°
• β: 112.77 ± 0.03°
• γ: 90°
• Cell volume: 1756.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1165
• Weighted residual factors for all reflections included in the refinement: 0.1411
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No