Information card for entry 7105727

Structure parameters

• Common name: N-(5-(allyloxy)-6-hydroxy-3-methyl-2-oxo-2,3- dihydrobenzofuran-3-yl)-P,P-diphenylphosphinic amide
• Chemical name: N-(5-(allyloxy)-6-hydroxy-3-methyl-2-oxo-2,3-dihydrobenzofuran-3-yl)- P,P-diphenylphosphinic amide
• Formula: C24 H22 N O5 P
• Calculated formula: C24 H22 N O5 P
• Title of publication: Asymmetric Total Synthesis of (+)-Fumimycin via 1,2-Addition to Ketimines
• Authors of publication: Patrick Gross; Filipp Furche; Martin Nieger; Stefan Brase
• Journal of publication: Chem.Commun.
• Year of publication: 2010
• Journal volume: 46
• Pages of publication: 9215
• a: 10.509 ± 0.001 Å
• b: 13.334 ± 0.001 Å
• c: 16.224 ± 0.001 Å
• α: 83.82 ± 0.01°
• β: 79.6 ± 0.01°
• γ: 75.14 ± 0.01°
• Cell volume: 2156.8 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.109
• Residual factor for significantly intense reflections: 0.0734
• Weighted residual factors for significantly intense reflections: 0.1846
• Weighted residual factors for all reflections included in the refinement: 0.21
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No