Information card for entry 7123580

Structure parameters

• Formula: C44 H30 Cu5 N2 O23
• Calculated formula: C44 H30 Cu5 N2 O23
• Title of publication: A nested Cu24@Cu72-based copper-organic polyhedral framework for selective adsorption of cationic dyes
• Authors of publication: Liu, Jin-Hua; Lin, Li-Dan; Li, Xin-Xiong; Zhao, Dan; Sun, Yan-Qiong; Zheng, Shou-Tian
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 27.5681 ± 0.0004 Å
• b: 27.5681 ± 0.0004 Å
• c: 27.5681 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 20951.8 ± 0.5 ų
• Cell temperature: 175 ± 2 K
• Ambient diffraction temperature: 175 ± 2 K
• Number of distinct elements: 5
• Space group number: 221
• Hermann-Mauguin space group symbol: P m -3 m
• Hall space group symbol: -P 4 2 3
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1279
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No