Information card for entry 7132436

Structure parameters

• Formula: C2 H11 B10
• Calculated formula: C2 H11 B10
• 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: 6.9432 ± 0.0003 Å
• b: 10.0433 ± 0.0005 Å
• c: 12.6587 ± 0.0006 Å
• α: 90°
• β: 97.066 ± 0.004°
• γ: 90°
• Cell volume: 876.02 ± 0.07 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1841
• Weighted residual factors for all reflections included in the refinement: 0.1896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No