Information card for entry 7157740

Structure parameters

• Formula: C26 H24 F N3
• Calculated formula: C26 H24 F N3
• Title of publication: Intermolecular fluoroamination of allenes towards substituted vinyl fluorides
• Authors of publication: Tiwari, Vibha; Bingham, Jacob T.; Vyas, Shubham; Singh, Anand
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2020
• Journal volume: 18
• Journal issue: 44
• Pages of publication: 9044 - 9049
• a: 5.6056 ± 0.0006 Å
• b: 17.422 ± 0.002 Å
• c: 22.161 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2164.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1026
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1217
• 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: No
• Has Fobs: No