Information card for entry 4020604

Structure parameters

• Formula: C11 H11 N O5
• Calculated formula: C11 H11 N O5
• SMILES: C(=C/c1ccc(cc1)OC)(C(=O)OC)/N(=O)=O
• Title of publication: Synthesis of β-Substituted α-Amino Acids via Lewis Acid Promoted Enantioselective Radical Conjugate Additions
• Authors of publication: Liwen He; G. S. C. Srikanth; Steven L. Castle
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 8140 - 8147
• a: 7.1832 ± 0.0014 Å
• b: 11.6551 ± 0.0016 Å
• c: 13.933 ± 0.002 Å
• α: 90°
• β: 100.988 ± 0.016°
• γ: 90°
• Cell volume: 1145.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No