Information card for entry 7124551

Structure parameters

• Common name: Y6-2nap
• Formula: C28 H19 N O2
• Calculated formula: C28 H19 N O2
• Title of publication: Catalytic enantioselective nucleophilic addition of ynamides to aldehydes.
• Authors of publication: Cook, Andrea M.; Wolf, Christian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2014
• Journal volume: 50
• Journal issue: 24
• Pages of publication: 3151 - 3154
• a: 8.0022 ± 0.001 Å
• b: 7.1348 ± 0.0009 Å
• c: 16.892 ± 0.002 Å
• α: 90°
• β: 92.706 ± 0.001°
• γ: 90°
• Cell volume: 963.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0323
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No