Information card for entry 1569272

Structure parameters

• Formula: C22 H19 N O
• Calculated formula: C22 H19 N O
• Title of publication: An interrupted Corey-Chaykovsky reaction of designed azaarenium salts: synthesis of complex polycyclic spiro- and fused cyclopropanoids.
• Authors of publication: Singh, Bara; Ansari, Arshad J.; Malik, Nirmal; Ramasastry, S. S. V.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 25
• Pages of publication: 6963 - 6969
• a: 10.4984 ± 0.0006 Å
• b: 13.6723 ± 0.0008 Å
• c: 12.6001 ± 0.0008 Å
• α: 90°
• β: 108.468 ± 0.007°
• γ: 90°
• Cell volume: 1715.44 ± 0.19 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 289 K
• Number of distinct elements: 4
• 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: 0.1075
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1825
• Weighted residual factors for all reflections included in the refinement: 0.2261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No