Information card for entry 7213263

Structure parameters

• Common name: RWX0441/Wilson/NW-G058/5107/24-4-97.
• Formula: C21 H27 N O2
• Calculated formula: C21 H27 N O2
• Title of publication: Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control
• Authors of publication: Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S.
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 2000
• Journal issue: 9
• Pages of publication: 1363
• a: 11.4254 ± 0.0004 Å
• b: 20.1558 ± 0.0006 Å
• c: 16.4936 ± 0.0005 Å
• α: 90°
• β: 99.506 ± 0.001°
• γ: 90°
• Cell volume: 3746.1 ± 0.2 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No