Information card for entry 7712230

Structure parameters

• Formula: O35 Tl4 W11
• Calculated formula: O35 Tl4 W11
• 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: 7.3114 ± 0.0008 Å
• b: 3.8154 ± 0.0004 Å
• c: 25.877 ± 0.003 Å
• α: 90°
• β: 98.109 ± 0.003°
• γ: 90°
• Cell volume: 714.65 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 3
• Hermann-Mauguin space group symbol: P 1 2 1
• Hall space group symbol: P 2y
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1368
• Weighted residual factors for all reflections included in the refinement: 0.1378
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No