Information card for entry 1100234

Structure parameters

• Chemical name: Methyl 3-phenyl-2-(N-methyl-N-t-butoxycarbonyl)aminopropanoate
• Formula: C16 H23 N O4
• Calculated formula: C16 H23 N O4
• SMILES: N(C(Cc1ccccc1)C(=O)OC)(C)C(=O)OC(C)(C)C
• Authors of publication: Harms, K.; Boche, G.; Marsch, M.
• Journal of publication: Private Communication
• Year of publication: 2001
• a: 29.6297 ± 0.0013 Å
• b: 8.8309 ± 0.0006 Å
• c: 12.8246 ± 0.0008 Å
• α: 90°
• β: 91.36 ± 0.005°
• γ: 90°
• Cell volume: 3354.7 ų
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 4.73
• Weighted residual factors for significantly intense reflections: 4.73
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No