Information card for entry 7715802

Structure parameters

• Formula: C58 H38 F18 O8 P2 Yb
• Calculated formula: C58 H38 F18 O8 P2 Yb
• Title of publication: Magneto-structural correlation in lanthanide luminescent [2.2]Paracyclophane-based Single-Molecule Magnets
• Authors of publication: Flichot, Hadrien; Sickinger, Annika; Brom, Jules; Lefeuvre, Bertrand; Dorcet, Vincent; Guizouarn, Thierry; Cador, Olivier; Le Guennic, Boris; laurent.micouin@u-paris.fr, laurent.micouin@u-paris.fr; Maury, Olivier; erica.benedetti@u-paris.fr, erica.benedetti@u-paris.fr; Pointillart, Fabrice
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 29.5507 ± 0.0006 Å
• b: 29.5507 Å
• c: 26.1095 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22800 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.0813
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1982
• Weighted residual factors for all reflections included in the refinement: 0.2057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No