Information card for entry 1520172

Structure parameters

• Chemical name: Maleic acid + morpholine
• Formula: C10 H17 N O5
• Calculated formula: C10 H17 N O5
• SMILES: C(=O)(CC(C(=O)OC)N1CCOCC1)OC
• Title of publication: Maleic acid + morpholine
• Authors of publication: Callear, Samantha K.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2008
• Pages of publication: 500
• a: 5.7683 ± 0.0009 Å
• b: 13.702 ± 0.003 Å
• c: 14.442 ± 0.003 Å
• α: 90°
• β: 97.458 ± 0.011°
• γ: 90°
• Cell volume: 1131.8 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.28
• Residual factor for significantly intense reflections: 0.1456
• Weighted residual factors for significantly intense reflections: 0.2528
• Weighted residual factors for all reflections included in the refinement: 0.3147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No