Information card for entry 1566740

Structure parameters

• Formula: C20 H10 B11 Cl11 F6
• Calculated formula: C20 H10 B11 Cl11 F6
• Title of publication: Isolable Fluorinated Triphenymethyl Cation Salts of [HCB11Cl11]-: Demonstration of Remarkable Hydride Affinity
• Authors of publication: Gunther, S. Olivia; Lee, Chun-I; Song, Ellen; Bhuvanesh, Nattamai; Ozerov, Oleg V.
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 21.8423 ± 0.0011 Å
• b: 11.6968 ± 0.0006 Å
• c: 19.7476 ± 0.001 Å
• α: 90°
• β: 98.58 ± 0.002°
• γ: 90°
• Cell volume: 4988.8 ± 0.4 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections included in the refinement: 0.0542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No