Information card for entry 7116912

Structure parameters

• Formula: C20 H20 F3 N O
• Calculated formula: C20 H20 F3 N O
• Title of publication: Palladium-catalyzed highly efficient synthesis of functionalized indolizines via cross-coupling/cycloisomerization cascade
• Authors of publication: Liangwei Zhang; Xiangdong Li; Yuanhong Liu; Dayong Zhang
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 6633
• a: 10.018 ± 0.007 Å
• b: 10.446 ± 0.007 Å
• c: 35.11 ± 0.02 Å
• α: 83.334 ± 0.018°
• β: 86.119 ± 0.017°
• γ: 76.252 ± 0.017°
• Cell volume: 3542 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.179
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.2153
• Weighted residual factors for all reflections included in the refinement: 0.2853
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No