Information card for entry 2017802

Structure parameters

• Common name: Zinc Ethylenediaminetetraacetate Monohydrate
• Chemical name: poly[aqua(μ~5~-ethylenediaminetetraacetato)dizinc(II)]
• Formula: C10 H14 N2 O9 Zn2
• Calculated formula: C10 H14 N2 O9 Zn2
• Title of publication: Hydrothermal synthesis and extended structure of poly[aqua(μ~5~-ethylenediaminetetraacetato)dizinc(II)]
• Authors of publication: Gelabert, Maria C.; Hart, Jennifer; Emge, Thomas J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: m327 - m329
• a: 12.7099 ± 0.0008 Å
• b: 11.2854 ± 0.0007 Å
• c: 9.4153 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1350.5 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0268
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes