Information card for entry 7160471

Structure parameters

• Formula: C18 H18 F3 N3 O
• Calculated formula: C18 H18 F3 N3 O
• Title of publication: Visible light-promoted cascade synthesis of pyrazolidinones <i>via N</i>-aryl glycine and azomethine imines.
• Authors of publication: Udari, Ganesh; Jansi Rani, A.; Sridhar, B.; Singh, Surya Prakash
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 19
• Pages of publication: 4666 - 4670
• a: 15.854 ± 0.007 Å
• b: 8.493 ± 0.004 Å
• c: 26.645 ± 0.011 Å
• α: 90°
• β: 101.786 ± 0.005°
• γ: 90°
• Cell volume: 3512 ± 3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1615
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.2163
• Weighted residual factors for all reflections included in the refinement: 0.2698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No