Information card for entry 4323464

Structure parameters

• Chemical name: Aquo(2-(hydroxyimino)propionate)sodium
• Formula: C3 H6 N Na O4
• Calculated formula: C3 H6 N Na O4
• SMILES: N(=C(\C(=O)[O-])C)/O.[Na+].O
• Title of publication: Synthesis and Spectroscopic and Thermal Decomposition Studies of Alkali Metal Salts of 2-Oximidopropionate
• Authors of publication: Allen W. Apblett; Galina D. Georgieva; Joel T. Mague
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 2656 - 2661
• a: 13.699 ± 0.003 Å
• b: 6.1577 ± 0.0007 Å
• c: 6.633 ± 0.001 Å
• α: 90°
• β: 103.09 ± 0.02°
• γ: 90°
• Cell volume: 544.98 ± 0.16 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.05
• Goodness-of-fit parameter for significantly intense reflections: 1.73
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No