Information card for entry 7133590

Structure parameters

• Chemical name: Chloro-tris(3,5-dimethylphenyl)bismuthonium tetrakis(3,5-bis(trifluoromethyl)phenyl)borate
• Formula: C56 H39 B Bi Cl F24
• Calculated formula: C56 H39 B Bi Cl F24
• Title of publication: Synthesis and Characterization of Chlorotriarylbismuthonium Salts
• Authors of publication: Kuziola, Jennifer; Nöthling, Nils; Leutzsch, Markus; Cornella, Josep
• Journal of publication: Chemical Communications
• Year of publication: 2024
• a: 18.1228 ± 0.0008 Å
• b: 15.8254 ± 0.0006 Å
• c: 20.0417 ± 0.0009 Å
• α: 90°
• β: 106.109 ± 0.002°
• γ: 90°
• Cell volume: 5522.3 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0486
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No