Information card for entry 7702754

Structure parameters

• Chemical name: 'Oxonium bis(chloranilate)yttrate.solvate'
• Formula: C20 H35 Cl4 O17 Y
• Calculated formula: C12 Cl4 O12.44 Y
• Title of publication: Dihydroxybenzoquinone and chloranilic acid derivatives of rare earth metals
• Authors of publication: Abrahams, Brendan F.; Coleiro, Joseph; Ha, Karen; Hoskins, Bernard F.; Orchard, Simon D.; Robson, Richard
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 8
• Pages of publication: 1586
• a: 11.578 ± 0.001 Å
• b: 11.578 ± 0.001 Å
• c: 25.391 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3403.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1392
• Residual factor for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections: 0.2721
• Weighted residual factors for significantly intense reflections: 0.2025
• Goodness-of-fit parameter for all reflections: 1.047
• Goodness-of-fit parameter for significantly intense reflections: 1.126
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No