Information card for entry 7110668

Structure parameters

• Formula: C22 H31 N O3
• Calculated formula: C22 H31 N O3
• Title of publication: Stereoselective radical-tandem reaction of aniline derivatives with (5R)-5-menthyloxy-2,5-dihydrofuran-2-one initiated by photochemical induced electron transfer
• Authors of publication: Bertrand, Samuel; Hoffmann, Norbert; Pete, Jean-Pierre; Bulach, Véronique
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 22
• Pages of publication: 2291
• a: 8.4839 ± 0.0003 Å
• b: 13.709 ± 0.001 Å
• c: 17.887 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2080.4 ± 0.2 ų
• Cell temperature: 294 K
• Ambient diffraction temperature: 294 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: 0.102
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections: 1.416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No