Information card for entry 2206323

Structure parameters

• Common name: ethylenediammonium hexaaquazinc(II) sulfate
• Chemical name: Ethane-1,2-diaminium hexaaquazinc(II) sulfate
• Formula: C2 H22 N2 O14 S2 Zn
• Calculated formula: C2 H22 N2 O14 S2 Zn
• SMILES: S(=O)(=O)([O-])[O-].C([NH3+])C[NH3+].[OH2][Zn]([OH2])([OH2])([OH2])([OH2])[OH2].S(=O)(=O)([O-])[O-]
• Title of publication: Ethane-1,2-diaminium hexaaquazinc(II) sulfate
• Authors of publication: Apinpus, Rujiwatra; Jumras, Limtrakul
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 7
• Pages of publication: m1403 - m1404
• a: 8.1827 ± 0.0006 Å
• b: 7.0914 ± 0.0005 Å
• c: 13.1674 ± 0.0009 Å
• α: 90°
• β: 101.154 ± 0.001°
• γ: 90°
• Cell volume: 749.63 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes