Information card for entry 1563550

Structure parameters

• Chemical name: 'Potassium thorium nitrate hydrate'
• Formula: K N5 O17 Th
• Calculated formula: K N5 O17 Th
• SMILES: [Th]12345(ON(=[O]2)=O)([O]=N(O4)=O)([O]=N(=O)O1)(ON(=[O]3)=O)([OH2])([OH2])ON(=O)=[O]5.[K+]
• Title of publication: Crystal chemistry of thorium nitrates and chromates
• Authors of publication: Sigmon, Ginger E.; Burns, Peter C.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2010
• Journal volume: 183
• Journal issue: 7
• Pages of publication: 1604 - 1608
• a: 10.0698 ± 0.0008 Å
• b: 12.7309 ± 0.0009 Å
• c: 13.2308 ± 0.0008 Å
• α: 90°
• β: 128.647 ± 0.004°
• γ: 90°
• Cell volume: 1324.71 ± 0.18 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0253
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.0483
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No