Information card for entry 7712225

Structure parameters

• Formula: Cs2 O22 W7
• Calculated formula: Cs2 O22 W7
• Title of publication: Synthesis, structural characterization, reactivity and catalytic activity of mixed halo/triflate ArI(OTf)(X) species
• Authors of publication: Dutton, Jason Laurence; Sharp-Bucknall, Lachlan; Sceney, Marcus; White, Keith Forrest
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 3.8497 ± 0.0003 Å
• b: 7.3502 ± 0.0005 Å
• c: 32.611 ± 0.003 Å
• α: 90°
• β: 90.006 ± 0.003°
• γ: 90°
• Cell volume: 922.76 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.142
• Residual factor for significantly intense reflections: 0.098
• Weighted residual factors for significantly intense reflections: 0.207
• Weighted residual factors for all reflections included in the refinement: 0.2376
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No