Information card for entry 7718656

Structure parameters

• Formula: C11 H26 B10 S
• Calculated formula: C11 H26 B10 S
• Title of publication: Catalytic regioselective 3,4-difunctionalization of 3-iodo-<i>o</i>-carborane <i>via</i> Pd migration.
• Authors of publication: Jiang, Xianren; Ding, Chang-Hua; Qiu, Zaozao; Xie, Zuowei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 22
• Pages of publication: 8764 - 8768
• a: 13.898 ± 0.003 Å
• b: 10.749 ± 0.002 Å
• c: 12.186 ± 0.002 Å
• α: 90°
• β: 110.728 ± 0.006°
• γ: 90°
• Cell volume: 1702.6 ± 0.6 ų
• Cell temperature: 190 K
• Ambient diffraction temperature: 190 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: 0.0672
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1203
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No