Information card for entry 7133849

Structure parameters

• Formula: C24 H49 B2 K O10
• Calculated formula: C24 H49 B2 K O10
• Title of publication: Csp2–H/F bond activation and borylation with low valent iron
• Authors of publication: Zars, Ethan; Pick, Lisa; Kankanamge, Achala; Gau, Michael; Meyer, Karsten; Mindiola, Daniel J.
• Journal of publication: Chemical Communications
• Year of publication: 2024
• a: 10.1611 ± 0.0001 Å
• b: 19.448 ± 0.0002 Å
• c: 15.5969 ± 0.0002 Å
• α: 90°
• β: 95.925 ± 0.001°
• γ: 90°
• Cell volume: 3065.69 ± 0.06 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No