Information card for entry 7159739

Structure parameters

• Formula: C32 H25 F N2 O Si
• Calculated formula: C32 H25 F N2 O Si
• SMILES: [Si](c1ccccc1)(c1n(nc2c1cc(F)cc2)c1ccc(OC)cc1)(c1ccccc1)c1ccccc1
• Title of publication: Silylation of 2<i>H</i>-indazoles by photoinduced hydrogen atom transfer catalysis.
• Authors of publication: Das, Krishna Kanta; Hajra, Alakananda
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2024
• Journal volume: 22
• Journal issue: 5
• Pages of publication: 1034 - 1037
• a: 9.84 ± 0.002 Å
• b: 12.074 ± 0.003 Å
• c: 13.093 ± 0.003 Å
• α: 102.89 ± 0.007°
• β: 107.408 ± 0.007°
• γ: 110.2 ± 0.006°
• Cell volume: 1297.2 ± 0.5 ų
• Cell temperature: 302 ± 2 K
• Ambient diffraction temperature: 302 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0765
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.1785
• Weighted residual factors for all reflections included in the refinement: 0.2039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.461
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No