Information card for entry 4126780

Structure parameters

• Common name: potassium thorium pentanitrate hydrate
• Formula: H15 K N5 O22.5 Th
• Calculated formula: H14 K N5 O22.5 Th
• Title of publication: Influence of Counter-Cation Hydration Enthalpies on the Formation of Molecular Complexes: A Thorium-Nitrate Example.
• Authors of publication: Jin, Geng Bang; Lin, Jian; Estes, Shanna L.; Skanthakumar, Suntharalingam; Soderholm, Lynda
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 10.3286 ± 0.0004 Å
• b: 13.2067 ± 0.0005 Å
• c: 13.9824 ± 0.0006 Å
• α: 95.3184 ± 0.0006°
• β: 90.4903 ± 0.0006°
• γ: 92.7271 ± 0.0005°
• Cell volume: 1896.77 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0278
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0424
• Weighted residual factors for all reflections included in the refinement: 0.0453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No