Information card for entry 7720974

Structure parameters

• Chemical name: 0419copy0409-3
• Formula: C56 H61 Dy N5 O3 P S2
• Calculated formula: C56 H61 Dy N5 O3 P S2
• Title of publication: Strongly axial monodentate carboxylate for dysprosium single-ion magnets.
• Authors of publication: Wen, Tao-Xiao; Liu, Jia-Chuan; Chen, Yan-Cong; Du, Shan-Nan; Wu, Si-Guo; Deng, Wei; Liu, Jun-Liang; Tong, Ming-Liang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 16
• Pages of publication: 6398 - 6406
• a: 9.7305 ± 0.0001 Å
• b: 23.5563 ± 0.0003 Å
• c: 23.6344 ± 0.0004 Å
• α: 90°
• β: 93.14 ± 0.001°
• γ: 90°
• Cell volume: 5409.22 ± 0.13 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1191
• Weighted residual factors for all reflections included in the refinement: 0.1209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No