Information card for entry 3000342

Structure parameters

• Chemical name: ammonium diaqua-<i>N</i>-carboxyethylasparthato zincate monohydrate
• Formula: C6 H16 N2 O9 Zn
• Authors of publication: Rakovský, Erik; Pateda, Yogeswara Rao; Chrappová, Jana
• Journal of publication: To be published in Crystallography Reports
• a: 7.7901 ± 0.0004 Å
• b: 11.2368 ± 0.0004 Å
• c: 13.2048 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1155.89 ± 0.08 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120.15 K
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0121
• Residual factor for significantly intense reflections: 0.0119
• Weighted residual factors for significantly intense reflections: 0.0314
• Weighted residual factors for all reflections included in the refinement: 0.0315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0636
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No