Information card for entry 7712118

Structure parameters

• Formula: C18 H6 B F9 O3
• Calculated formula: C18 H6 B F9 O3
• Title of publication: Synthesis and lewis acidity of fluorinated triaryl borates.
• Authors of publication: Alharbi, Mashael M.; van Ingen, Yara; Roldan, Alberto; Kaehler, Tanja; Melen, Rebecca L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1820 - 1825
• a: 16.089 ± 0.0003 Å
• b: 11.633 ± 0.0003 Å
• c: 17.9172 ± 0.0004 Å
• α: 90°
• β: 94.514 ± 0.002°
• γ: 90°
• Cell volume: 3343.04 ± 0.13 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0888
• Weighted residual factors for all reflections included in the refinement: 0.0973
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No