Information card for entry 7712002

Structure parameters

• Formula: C47 H52 Cd N3 O16
• Calculated formula: C44 H41 Cd N2 O13
• Title of publication: Ferric ion substitution renders cadmium metal-organic framework derivatives for modulated Li storage based on local oxidation active centers.
• Authors of publication: Jiang, Wei; Gao, Baihui; Yan, Guosong; Xu, Shichong; Chu, Xianyu; Che, Guangbo; Liu, Bo; Lu, Ming; Liu, Chunbo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 754 - 762
• a: 21.479 ± 0.004 Å
• b: 7.9353 ± 0.0016 Å
• c: 32.66 ± 0.006 Å
• α: 90°
• β: 105.015 ± 0.004°
• γ: 90°
• Cell volume: 5376.6 ± 1.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.123
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1404
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 0.938
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No