Information card for entry 4060231

Structure parameters

• Formula: C7 H22 B10
• Calculated formula: C7 H22 B10
• SMILES: [BH]1234[BH]567[BH]891[BH]1%102[BH]2%11%12[BH]91([BH]178[B]76([BH]35([BH]4%102[H]%12)[H]7)([C@H]2[C@@H]3C=C[C@H](C2)C3)[H]1)[H]%11.[BH]1234[BH]567[BH]891[BH]1%102[BH]2%11%12[BH]91([BH]178[B]76([BH]35([BH]4%102[H]%12)[H]7)([C@@H]2[C@H]3C=C[C@@H](C2)C3)[H]1)[H]%11
• Title of publication: New Routes to Organodecaborane Polymers via Ruthenium-Catalyzed Ring-Opening Metathesis Polymerization
• Authors of publication: Xiaolan Wei; Patrick J. Carroll; Larry G. Sneddon
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Pages of publication: 163 - 165
• a: 10.906 ± 0.002 Å
• b: 13.048 ± 0.002 Å
• c: 10.811 ± 0.002 Å
• α: 90°
• β: 117.287 ± 0.003°
• γ: 90°
• Cell volume: 1367.3 ± 0.5 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 K
• Number of distinct elements: 3
• 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: 0.0901
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.2035
• Weighted residual factors for all reflections included in the refinement: 0.2184
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No