Information card for entry 7123721

Structure parameters

• Formula: C26 H28 B10
• Calculated formula: C26 H28 B10
• Title of publication: Icosahedral carboranes as scaffolds for congested regioselective polyaryl compounds. The distinct distance tuning of C-C and its antipodal B-B.
• Authors of publication: Vinas, Clara; Kelemen, Zsolt; Pepiol, Ariadna; Lupu, Marius; Sillanpää, Reijo; Hänninen, Mikko; Teixidor, Francesc
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.0809 ± 0.0003 Å
• b: 9.02379 ± 0.00019 Å
• c: 13.9208 ± 0.0003 Å
• α: 90°
• β: 100.834 ± 0.002°
• γ: 90°
• Cell volume: 1243.77 ± 0.05 ų
• Cell temperature: 120.01 ± 0.1 K
• Ambient diffraction temperature: 120.01 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.0989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No