Information card for entry 7702954

Structure parameters

• Formula: C56 H34 Dy2 F12 N8 O10 S4
• Calculated formula: C56 H34 Dy2 F12 N8 O10 S4
• Title of publication: Modulating magnetic dynamics through tailoring the terminal ligands in Dy₂ single-molecule magnets.
• Authors of publication: Cen, Peipei; Liu, Xiangyu; Zhang, Yi-Quan; Ferrando-Soria, Jesús; Xie, Gang; Chen, Sanping; Pardo, Emilio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 808 - 816
• a: 13.6044 ± 0.0004 Å
• b: 13.6044 ± 0.0004 Å
• c: 28.6443 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4591.2 ± 0.2 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 144
• Hermann-Mauguin space group symbol: P 31
• Hall space group symbol: P 31
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No