Information card for entry 2003435

Structure parameters

• Formula: C7 H13 N O4
• Calculated formula: C7 H13 N O4
• SMILES: OCC(NC(=O)C=C)(CO)CO
• Title of publication: 2-Acrylamido-2-hydroxymethylpropan-1,3-diol
• Authors of publication: Oddon, Y.; Reboul, J.-P.; Pèpe, G.; Siri, D.; Pucci, B.; Pavia, A. A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 974 - 976
• a: 6.025 ± 0.004 Å
• b: 7.566 ± 0.004 Å
• c: 9.588 ± 0.005 Å
• α: 90°
• β: 101.64 ± 0.04°
• γ: 90°
• Cell volume: 428.1 ± 0.4 ų
• Cell temperature: 293 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.031
• Goodness-of-fit parameter for significantly intense reflections: 0.21
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No