Information card for entry 7153259

Structure parameters

• Formula: C19 H27 N3 O5
• Calculated formula: C19 H27 N3 O5
• SMILES: O(C(=O)N[C@H](C(=O)ON1CC(=O)N([C@]1(C(C)C)C)C)Cc1ccccc1)C
• Title of publication: MiPNO, a new chiral cyclic nitrone for enantioselective amino acid synthesis: the cycloaddition approach.
• Authors of publication: Thiverny, Maryse; Philouze, Christian; Chavant, Pierre Yves; Blandin, Véronique
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2010
• Journal volume: 8
• Journal issue: 4
• Pages of publication: 864 - 872
• a: 10.08 ± 0.003 Å
• b: 9.129 ± 0.004 Å
• c: 11.61 ± 0.003 Å
• α: 90°
• β: 112.49 ± 0.03°
• γ: 90°
• Cell volume: 987.1 ± 0.6 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0531
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections: 1.948
• Goodness-of-fit parameter for all reflections included in the refinement: 1.948
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No