Information card for entry 7228569

Structure parameters

• Formula: C60 H68 B Cs F24 O7
• Calculated formula: C60 H68 B Cs F24 O7
• Title of publication: Syntheses, characterisation and solid-state study of alkali and ammonium BArF salts
• Authors of publication: Carreras, Lucas; Rovira, Laura; Vaquero, Mónica; Mon, Ignasi; Martin, Eddy; Benet-Buchholz, Jordi; Vidal-Ferran, Anton
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 52
• Pages of publication: 32833
• a: 13.0651 ± 0.0015 Å
• b: 13.0711 ± 0.0014 Å
• c: 38.978 ± 0.004 Å
• α: 87.174 ± 0.003°
• β: 84.108 ± 0.003°
• γ: 89.978 ± 0.003°
• Cell volume: 6613.2 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0967
• Residual factor for significantly intense reflections: 0.0879
• Weighted residual factors for significantly intense reflections: 0.2286
• Weighted residual factors for all reflections included in the refinement: 0.2359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No