Information card for entry 4037128

Structure parameters

• Formula: C15 H25 N O5
• Calculated formula: C15 H25 N O5
• Title of publication: Synthesis of ω-Oxo Amino Acids and trans-5-Substituted Proline Derivatives Using Cross-Metathesis of Unsaturated Amino Acids.
• Authors of publication: Salih, Nabaz; Adams, Harry; Jackson, Richard F. W.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2016
• Journal volume: 81
• Journal issue: 18
• Pages of publication: 8386 - 8393
• a: 8.8171 ± 0.0006 Å
• b: 8.8171 ± 0.0006 Å
• c: 42.31 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3289.2 ± 0.4 ų
• Cell temperature: 97 ± 2 K
• Ambient diffraction temperature: 97 ± 2 K
• Number of distinct elements: 4
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.0615
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1267
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No