Information card for entry 7157582

Structure parameters

• Formula: C29 H20 F3 N O2
• Calculated formula: C29 H20 F3 N O2
• Title of publication: Organocatalytic C3-functionalization of indolizines: synthesis of biologically important indolizine derivatives.
• Authors of publication: Zhang, Yi-Zhu; Sheng, Feng-Tao; Zhu, Zuoquan; Li, Zhi-Ming; Zhang, Shu; Tan, Wei; Shi, Feng
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2020
• Journal volume: 18
• Journal issue: 29
• Pages of publication: 5688 - 5696
• a: 10.333 ± 0.004 Å
• b: 10.46 ± 0.004 Å
• c: 11.583 ± 0.005 Å
• α: 88.838 ± 0.005°
• β: 68.455 ± 0.005°
• γ: 79.684 ± 0.006°
• Cell volume: 1144.2 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.0887
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.1617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No