Information card for entry 4330281

Structure parameters

• Formula: C32 H72 N8 O18 Pu
• Calculated formula: C32 H72 N8 O18 Pu
• SMILES: C(CCC)[N+](CCCC)(CCCC)CCCC.N1(=[O][Pu]23456(O1)(ON(=O)=[O]2)(ON(=O)=[O]5)([O]=N(=O)O3)(ON(=O)=[O]4)ON(=O)=[O]6)=O.C(CCC)[N+](CCCC)(CCCC)CCCC
• Title of publication: [N(n-Bu)4]2[Pu(NO3)6] and [N(n-Bu)4]2[PuCl6]: Starting Materials To Facilitate Nonaqueous Plutonium(IV) Chemistry
• Authors of publication: Sean D. Reilly; Brian L. Scott; Andrew J. Gaunt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 9165 - 9167
• a: 10.453 ± 0.001 Å
• b: 19.0104 ± 0.0019 Å
• c: 11.7359 ± 0.0012 Å
• α: 90°
• β: 94.083 ± 0.001°
• γ: 90°
• Cell volume: 2326.2 ± 0.4 ų
• Cell temperature: 141 ± 2 K
• Ambient diffraction temperature: 141 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for significantly intense reflections: 0.0449
• Weighted residual factors for all reflections included in the refinement: 0.0474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.362
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No