Information card for entry 4102154

Structure parameters

• Formula: C5 H11 B11 Cl12
• Calculated formula: C5 H11 B11 Cl12
• Title of publication: Dialkyl Chloronium Ions
• Authors of publication: Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 4062 - 4063
• a: 12.1037 ± 0.0009 Å
• b: 12.5612 ± 0.0009 Å
• c: 15.1027 ± 0.0011 Å
• α: 90°
• β: 94.4358 ± 0.0013°
• γ: 90°
• Cell volume: 2289.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0583
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No