Information card for entry 1572137

Structure parameters

• Formula: C203 H178 F24 N12 O5 P4 Rh4
• Calculated formula: C203 H178 F24 N12 O5 P4 Rh4
• Title of publication: A corannulene-based metallobox for the encapsulation of fullerenes.
• Authors of publication: Ibáñez, Susana; Mejuto, Carmen; Cerón, Katherin; Sanz Miguel, Pablo J.; Peris, Eduardo
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 33
• Pages of publication: 13415 - 13420
• a: 17.8348 ± 0.0014 Å
• b: 22.4557 ± 0.0019 Å
• c: 25.22 ± 0.002 Å
• α: 105.856 ± 0.003°
• β: 107.732 ± 0.002°
• γ: 105.18 ± 0.002°
• Cell volume: 8573.1 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1806
• Residual factor for significantly intense reflections: 0.1129
• Weighted residual factors for significantly intense reflections: 0.3092
• Weighted residual factors for all reflections included in the refinement: 0.3582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No