Information card for entry 7120148

Structure parameters

• Formula: C48 H211 Cu24 Gd6 N24 Na O151
• Calculated formula: C48 H74 Cu24 Gd6 N24 Na O151
• Title of publication: Cluster-based MOFs with accelerated chemical conversion of CO2 through C‒C bond formation
• Authors of publication: Xiong, Gang; Yu, Bing; Dong, Jie; Shi, Ying; Zhao, Bin; He, Liang-Nian
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 17.0801 ± 0.0007 Å
• b: 17.8312 ± 0.0007 Å
• c: 17.941 ± 0.0005 Å
• α: 87.087 ± 0.003°
• β: 71.317 ± 0.003°
• γ: 64.441 ± 0.004°
• Cell volume: 4645.2 ± 0.4 ų
• Cell temperature: 123.3 ± 0.3 K
• Ambient diffraction temperature: 123.3 ± 0.3 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No