Information card for entry 7119035

Structure parameters

• Formula: C216 H228 F96 N72 Sb16 Zn8
• Calculated formula: C216 H237 F84.0002 N72 Sb14.0002 Zn8
• Title of publication: M8L12 cubic cages with all facial delta or facial lamda configuration: effects of surface anions on the occupancy of the cage and anion exchange
• Authors of publication: Jing Yang; Xiao-Yong Chang; Kiu-Chor Sham; Shek-Man Yiu; Hoi-Lun Kwong; Chi-Ming Che
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 5981
• a: 40.8424 ± 0.0009 Å
• b: 40.8424 ± 0.0009 Å
• c: 40.8424 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 68129 ± 3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.1065
• Residual factor for significantly intense reflections: 0.0977
• Weighted residual factors for significantly intense reflections: 0.2862
• Weighted residual factors for all reflections included in the refinement: 0.2969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No