Information card for entry 7132437

Structure parameters

• Formula: C20 H34 B20
• Calculated formula: C20 H34 B20
• Title of publication: 9,9'-Bis-<i>o</i>-carboranes: synthesis and exploration of properties.
• Authors of publication: Chen, Feijing; Guo, Wenjing; Ma, Yan-Na; Chen, Xuenian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 5
• Pages of publication: 614 - 617
• a: 20.2379 ± 0.0007 Å
• b: 7.7225 ± 0.0002 Å
• c: 18.3961 ± 0.0006 Å
• α: 90°
• β: 96.014 ± 0.003°
• γ: 90°
• Cell volume: 2859.25 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1137
• Residual factor for significantly intense reflections: 0.0988
• Weighted residual factors for significantly intense reflections: 0.2969
• Weighted residual factors for all reflections included in the refinement: 0.3124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No