Information card for entry 7711813

Structure parameters

• Formula: C2 H0.5 F3 K0.5 O2
• Calculated formula: C2 H0.5 F3 K0.5 O2
• Title of publication: Reactivity of bi- and monometallic trifluoroacetates towards amorphous SiO2
• Authors of publication: Munasinghe, Hashini N.; Imer, Marcos R.; Szlag, Regina G.; Suescun, Leopoldo; Rabuffetti, Federico A.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.442 ± 0.004 Å
• b: 10.021 ± 0.003 Å
• c: 8.688 ± 0.005 Å
• α: 90°
• β: 128.044 ± 0.005°
• γ: 90°
• Cell volume: 784.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No