Information card for entry 4038307

Structure parameters

• Formula: C23 H29 N2 O4 P
• Calculated formula: C23 H29 N2 O4 P
• Title of publication: Brönsted Acid Catalyzed Multicomponent Synthesis of Phosphorus and Fluorine-Derived γ-Lactam Derivatives.
• Authors of publication: Del Corte, Xabier; López-Francés, Adrián; Maestro, Aitor; Martinez de Marigorta, Edorta; Palacios, Francisco; Vicario, Javier
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2020
• a: 9.7426 ± 0.0009 Å
• b: 6.4084 ± 0.0005 Å
• c: 18.2313 ± 0.0014 Å
• α: 90°
• β: 99.544 ± 0.008°
• γ: 90°
• Cell volume: 1122.51 ± 0.16 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0942
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1336
• Weighted residual factors for all reflections included in the refinement: 0.1512
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No