Information card for entry 7160340

Structure parameters

• Formula: C16 H10 F6 N2 O
• Calculated formula: C16 H10 F6 N2 O
• Title of publication: An efficient direct electrolysis method for the synthesis of 1,1,1,3,3,3-hexafluoroisopropyxy substituted imidazo[1,2-<i>a</i>]pyridines.
• Authors of publication: Kong, Yanyan; Gong, Ming; Xu, Xuemei; Wu, Yangjie; Jiang, Xingmao
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 9
• Pages of publication: 2190 - 2194
• a: 9.4804 ± 0.0002 Å
• b: 10.7171 ± 0.0003 Å
• c: 14.9246 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1516.38 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No