Information card for entry 4306089

Structure parameters

• Formula: C6 H24 B10 O
• Calculated formula: C6 H24 B10 O
• SMILES: [BH]1234[BH]567[BH]891[BH]1%102[BH]2%119[BH]978[B]76([BH]35([BH]34%10[BH]12([H]%11)[H]3)[H]7)(CCCCC(=O)C)[H]9
• Title of publication: Ionic-Liquid-Promoted Decaborane Olefin-Hydroboration: A New Efficient Route to 6-R-B10H13 Derivatives
• Authors of publication: Upal Kusari; Patrick J. Carroll; Larry G. Sneddon
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 9203 - 9215
• a: 17.1457 ± 0.0015 Å
• b: 13.4183 ± 0.0011 Å
• c: 25.82 ± 0.002 Å
• α: 90°
• β: 96.949 ± 0.002°
• γ: 90°
• Cell volume: 5896.7 ± 0.8 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 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: 0.1026
• Residual factor for significantly intense reflections: 0.0655
• Weighted residual factors for significantly intense reflections: 0.1692
• Weighted residual factors for all reflections included in the refinement: 0.1993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No