Information card for entry 1569664

Structure parameters

• Formula: C18 H15 N O2
• Calculated formula: C18 H15 N O2
• Title of publication: Azido-alkynylation of alkenes through radical-polar crossover.
• Authors of publication: Borrel, Julien; Waser, Jerome
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 35
• Pages of publication: 9452 - 9460
• a: 5.80631 ± 0.00011 Å
• b: 7.77611 ± 0.00012 Å
• c: 31.5189 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1423.09 ± 0.04 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 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: 0.0318
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.077
• Weighted residual factors for all reflections included in the refinement: 0.0782
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No