Information card for entry 4001840

Structure parameters

• Formula: Er H5 O10 S2
• Calculated formula: Er H5 O10 S2
• SMILES: [Er+3].S(=O)(=O)([O-])[O-].S(=O)(=O)([O-])[O-].[OH2][H][OH2]
• Title of publication: Synthesis, Crystal Structure, and Thermal Behavior of the Rare Earth Sulfates (H5O2)M(SO4)2(M = Ho, Er, Y)
• Authors of publication: Wickleder, Mathias S.
• Journal of publication: Chemistry of Materials
• Year of publication: 1998
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 3212
• a: 6.8967 ± 0.0007 Å
• b: 6.8967 ± 0.0007 Å
• c: 17.166 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 816.49 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 141
• Hermann-Mauguin space group symbol: I 41/a m d :2
• Hall space group symbol: -I 4bd 2
• Residual factor for all reflections: 0.0126
• Residual factor for significantly intense reflections: 0.0122
• Weighted residual factors for all reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0353
• Goodness-of-fit parameter for all reflections: 1.042
• Goodness-of-fit parameter for significantly intense reflections: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No