Information card for entry 4315268

Structure parameters

• Formula: C18 H42 B10
• Calculated formula: C18 H42 B10
• SMILES: [BH]1234[BH]567[BH]891[BH]1%102[BH]2%119[BH]978[B]76([BH]35([BH]34%10[B]12(C(=C)CC1CCCCC1)([H]%11)[H]3)[H]7)(C(=C)CC1CCCCC1)[H]9
• Title of publication: Metal-Catalyzed Decaborane-Alkyne Hydroboration Reactions: Efficient Routes to Alkenyldecaboranes
• Authors of publication: Shahana Chatterjee; Patrick J. Carroll; Larry G. Sneddon
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 3095 - 3097
• a: 10.9921 ± 0.0017 Å
• b: 12.957 ± 0.002 Å
• c: 17.301 ± 0.003 Å
• α: 97.65 ± 0.006°
• β: 96.083 ± 0.005°
• γ: 90.37 ± 0.004°
• Cell volume: 2427.9 ± 0.7 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No