Information card for entry 2001338

Structure parameters

• Common name: Phosphinoalanine monohydrate, 2-amino-3-phosphinopropanoic acid monohydrate
• Chemical name: 2-Amino-2-carboxyethylphosphinic acid monohydrate
• Formula: C3 H10 N O5 P
• Calculated formula: C3 H10 N O5 P
• Title of publication: 2-Amino-2-carboxyethylphosphinic acid monohydrate
• Authors of publication: Schwalbe, C. H. W.; Freeman, S.; DasGupta, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 10
• Pages of publication: 1826 - 1828
• a: 6.669 ± 0.002 Å
• b: 14.842 ± 0.001 Å
• c: 7.7 ± 0.001 Å
• α: 90°
• β: 96.58 ± 0.01°
• γ: 90°
• Cell volume: 757.1 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.047
• Goodness-of-fit parameter for significantly intense reflections: 0.44
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No