Information card for entry 7057767

Structure parameters

• Formula: C59 H85 Co Dy O13 P3 S4
• Calculated formula: C59 H85 Co Dy O13 P3 S4
• Title of publication: Thiacalix[4]arene-supported mononuclear lanthanide compounds: slow magnetic relaxation in dysprosium and erbium analogues
• Authors of publication: Ge, Jing-Yuan; Chen, Zhongyan; Wang, Hai-Ying; Wang, Haiou; Wang, Peng; Duan, Xing; Huo, Dexuan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 22
• Pages of publication: 17968
• a: 11.2941 ± 0.0012 Å
• b: 16.0878 ± 0.0017 Å
• c: 20.25 ± 0.002 Å
• α: 99.308 ± 0.002°
• β: 99.692 ± 0.002°
• γ: 102.967 ± 0.002°
• Cell volume: 3457.3 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0463
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No