Information card for entry 4341979

Structure parameters

• Formula: C38.25 H42.25 N7.75 O16.75 Zn3
• Calculated formula: C38.25 H42.25 N7.75 O16.75 Zn3
• Title of publication: Assembly of Metal-Organic Frameworks Based on 3,3',5,5'-Azobenzene-tetracarboxylic Acid: Photoluminescences, Magnetic Properties, and Gas Separations.
• Authors of publication: Zhang, Shaowei; Ma, Jiangong; Zhang, Xiaoping; Duan, Eryue; Cheng, Peng
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 586 - 595
• a: 21.7672 ± 0.0005 Å
• b: 19.633 ± 0.0005 Å
• c: 29.4028 ± 0.0006 Å
• α: 90°
• β: 99.478 ± 0.002°
• γ: 90°
• Cell volume: 12393.9 ± 0.5 ų
• Cell temperature: 128.6 ± 0.14 K
• Ambient diffraction temperature: 128.6 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/c 1
• Hall space group symbol: -I 2yc
• Residual factor for all reflections: 0.0527
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1298
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No