Information card for entry 7212828

Structure parameters

• Formula: C18 H24 B10 O
• Calculated formula: C18 H24 B10 O
• Title of publication: Crystal engineering of o-carboranyl alcohols: syntheses, crystal structures and thermal properties
• Authors of publication: Terrasson, Vincent; García, Yolanda; Farràs, Pau; Teixidor, Francesc; Viñas, Clara; Planas, José Giner; Prim, Damien; Light, Mark E.; Hursthouse, Michael B.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 4109
• a: 19.1234 ± 0.0008 Å
• b: 9.0888 ± 0.0004 Å
• c: 23.1603 ± 0.0007 Å
• α: 90°
• β: 95.767 ± 0.002°
• γ: 90°
• Cell volume: 4005.1 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.1555
• Residual factor for significantly intense reflections: 0.0868
• Weighted residual factors for significantly intense reflections: 0.1971
• Weighted residual factors for all reflections included in the refinement: 0.2359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No