Information card for entry 7240873

Structure parameters

• Common name: N-Acetyl-L-4-hydroxyproline
• Chemical name: Oxaceprol
• Formula: C7 H11 N O4
• Calculated formula: C7 H11 N O4
• Title of publication: Disappearing Disorder
• Authors of publication: Dittrich, Birger; Sever, Christoph; Luebben, Jens
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 7.316 ± 0.003 Å
• b: 10.616 ± 0.005 Å
• c: 10.65 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 827.1 ± 0.6 ų
• Cell temperature: 215 ± 2 K
• Ambient diffraction temperature: 215 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0579
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1345
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.6199 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No