Information card for entry 7124871

Structure parameters

• Formula: C11 H20 B10 O3
• Calculated formula: C11 H20 B10 O3
• Title of publication: Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.
• Authors of publication: Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 71
• Pages of publication: 10767 - 10770
• a: 22.1533 ± 0.0003 Å
• b: 6.78019 ± 0.00007 Å
• c: 23.3341 ± 0.0003 Å
• α: 90°
• β: 100.05 ± 0.0011°
• γ: 90°
• Cell volume: 3451.09 ± 0.07 ų
• Cell temperature: 99.96 ± 0.1 K
• Ambient diffraction temperature: 99.96 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0533
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1247
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No