Information card for entry 7719555

Structure parameters

• Formula: C72 H60 As4 Cl2 F6 O4 P Yb
• Calculated formula: C72 H60 As4 Cl2 F6 O4 P Yb
• Title of publication: Leveraging anion selection to modulate crystallographic symmetry in Yb(III) single-molecule magnets.
• Authors of publication: Lowe, Ethan; Hourston, Hamish; Sharma, Tanu; Dugmore, Sarah K.; Wilson, Claire; Rajaraman, Gopalan; Murrie, Mark
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 37
• Pages of publication: 14070 - 14078
• a: 10.8767 ± 0.0007 Å
• b: 17.1693 ± 0.001 Å
• c: 18.8632 ± 0.0011 Å
• α: 80.221 ± 0.002°
• β: 73.486 ± 0.002°
• γ: 85.695 ± 0.002°
• Cell volume: 3326.9 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No