Information card for entry 4108085

Structure parameters

• Formula: C17 H20 N O P
• Calculated formula: C17 H20 N O P
• Title of publication: Catalytic Scaffolding Ligands: An Efficient Strategy for Directing Reactions
• Authors of publication: Thomas E. Lightburn; Michael T. Dombrowski; Kian L. Tan
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 9210 - 9211
• a: 5.663 ± 0.0009 Å
• b: 16.205 ± 0.003 Å
• c: 16.938 ± 0.003 Å
• α: 90°
• β: 92.227 ± 0.002°
• γ: 90°
• Cell volume: 1553.2 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• 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: 0.0615
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1172
• Weighted residual factors for all reflections included in the refinement: 0.127
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No