Information card for entry 4038304

Structure parameters

• Formula: C23 H27 F N O5 P
• Calculated formula: C23 H27 F N O5 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: 11.5648 ± 0.0005 Å
• b: 12.906 ± 0.0005 Å
• c: 17.0405 ± 0.0005 Å
• α: 71.639 ± 0.003°
• β: 88.416 ± 0.003°
• γ: 72.869 ± 0.003°
• Cell volume: 2300.85 ± 0.16 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No