Information card for entry 4506187

Structure parameters

• Formula: C84 H100 Dy4 O36 S8
• Calculated formula: C84 H100 Dy4 O36 S8
• Title of publication: Syntheses, Crystal Structures, and Magnetic Properties of Twop-tert-Butylsulfonylcalix[4]arene Supported Cluster Complexes with a Totally Disordered Ln4(OH)4Cubane Core
• Authors of publication: Liu, Cai-Ming; Zhang, De-Qing; Hao, Xiang; Zhu, Dao-Ben
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 6
• Pages of publication: 2948
• a: 32.308 ± 0.006 Å
• b: 12.271 ± 0.002 Å
• c: 20.7 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8207 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0823
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1811
• Weighted residual factors for all reflections included in the refinement: 0.1899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No