Information card for entry 4118983

Structure parameters

• Common name: lithium sodium U24
• Formula: Li2 Na21 O200 U24
• Calculated formula: Li2 Na21 O200 U24
• SMILES: [U]12345([O]6[U]789(O[U]%10%11%12([O]%13[U]%14%15%16(O[U]%17%18%19(O%14)(=O)([O]%14[U]%20%21%22(O[U]%23%24%25([O]%26[U]%27%28%29(O[U]%30%31([O]%32[U]%33%34(O[U]%35%36%37(O%33)(=O)([O]%33[U]%38(O1)(=O)([O]%36%33)(=O)(O4)[O]1[U]4%33%36(O[U]%39%40%41([O]%42[U]%43%44%45(O[U]%46%47([O]%24[O]%25%47)([O]%24[U]%25%47(=O)(=O)(O[U]%48%49([O]%35[O]%37%48)(=O)(=O)([O]%33[O]%36%49)[O]%47)([O]%27[O]%29%25)[O]%46%24[U]%24%25%27([O]7[O]9%24)(=O)(=O)O[U]79([O]%17[O]%197)(=O)(=O)([O]7[U]%17%19(O[U]%24%29([O]%33[U]%35%36(O[U]%37%46([O]3[O]5%46)([O]%25[O]%37)(O%35)(=O)=O)(=O)([O]%39[O]%40%36)(=O)[O]%24%33)([O]%17)(=O)([O]%43[O]%45%29)=O)(=O)([O]%21[O]%22%19)([O]97)=O)[O]%27)(O%44)(=O)=O)([O]%41%42)(=O)=O)(O4)(=O)=O)(=O)([O]%381)=O)=O)(=O)([O]%10[O]%11%34)(=O)[O]%30%32)(=O)([O]%15[O]%16%31)(O%28)=O)(=O)(=O)[O]%23%26)(=O)(=O)O%20)(=O)([O]%18%14)=O)=O)([O]%12%13)(=O)=O)(=O)(O8)=O)(=O)(=O)[O]26)(=O)=O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Li+].O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Li+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Dynamics of Uranyl Peroxide Nanocapsules
• Authors of publication: May Nyman; Todd M. Alam
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 20131 - 20138
• a: 26.184 ± 0.002 Å
• b: 26.175 ± 0.002 Å
• c: 18.4154 ± 0.0017 Å
• α: 90°
• β: 132.259 ± 0.001°
• γ: 90°
• Cell volume: 9341.2 ± 1.3 ų
• Cell temperature: 188 ± 2 K
• Ambient diffraction temperature: 188 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No