Information card for entry 4307233

Structure parameters

• Formula: H16 N6 O26 Th2
• Calculated formula: H18 N6 O28 Th2
• SMILES: N1(=[O][Th]234([OH2])([OH2])(O1)([OH][Th]156([OH]2)([OH2])([OH2])([OH2])(ON(=[O]1)=O)([O]=N(=O)O5)ON(=[O]6)=O)([OH2])(ON(=[O]3)=O)ON(=O)=[O]4)=O.O.O
• Title of publication: Structures of Dimeric Hydrolysis Products of Thorium
• Authors of publication: Richard E. Wilson; S. Skanthakumar; Ginger Sigmon; Peter C. Burns; L. Soderholm
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 2368 - 2372
• a: 6.792 ± 0.002 Å
• b: 11.71 ± 0.004 Å
• c: 13.778 ± 0.005 Å
• α: 90°
• β: 102.714 ± 0.005°
• γ: 90°
• Cell volume: 1069 ± 0.6 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0745
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.1276
• Goodness-of-fit parameter for all reflections included in the refinement: 0.878
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No