Information card for entry 7129963

Structure parameters

• Formula: C66 H95 F2 K N2 O6 Si Zn
• Calculated formula: C66 H95 F2 K N2 O6 Si Zn
• Title of publication: Metallation of sensitive fluoroarenes using a potassium TMP-zincate supported by a silyl(bis)amido ligand
• Authors of publication: Mastropierro, Pasquale; Kennedy, Alan R.; Hevia, Eva
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 18.6356 ± 0.0002 Å
• b: 18.8587 ± 0.0003 Å
• c: 18.8788 ± 0.0003 Å
• α: 90.4963 ± 0.0014°
• β: 93.1729 ± 0.0012°
• γ: 92.1929 ± 0.0012°
• Cell volume: 6619.42 ± 0.17 ų
• Cell temperature: 173.01 ± 0.1 K
• Ambient diffraction temperature: 173.15 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1576
• Residual factor for significantly intense reflections: 0.1143
• Weighted residual factors for significantly intense reflections: 0.3376
• Weighted residual factors for all reflections included in the refinement: 0.3734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.338
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No