Information card for entry 7714459

Structure parameters

• Formula: C57.5 H79.5 Dy4 N8.5 O40.5
• Calculated formula: C32 H20 Dy4 O32
• Title of publication: Assembly of dysprosium(III) cubanes in metal–organic framework with ecu topology and slow magnetic relaxation
• Authors of publication: Shao, Dong; Wan, Yi; Yang, Jiong; Zhu, Junlun; Ruan, Zhijun; Shi, Le
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 13.442 ± 0.004 Å
• b: 21.256 ± 0.006 Å
• c: 17.195 ± 0.005 Å
• α: 90°
• β: 108.984 ± 0.011°
• γ: 90°
• Cell volume: 4646 ± 2 ų
• Cell temperature: 281 K
• Ambient diffraction temperature: 281 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0508
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.1122
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No