Information card for entry 4305984

Structure parameters

• Formula: C24 H48 Cl7 O6 Pu2
• Calculated formula: C24 H48 Cl7 O6 Pu2
• SMILES: C1CCC[O]1[Pu]([O]1CCCC1)(Cl)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)Cl.[O]1(CCCC1)[Pu](Cl)(Cl)(Cl)(Cl)Cl
• Title of publication: Low-Valent Molecular Plutonium Halide Complexes
• Authors of publication: Andrew J. Gaunt; Sean D. Reilly; Alejandro E. Enriquez; Trevor W. Hayton; James M. Boncella; Brian L. Scott; Mary P. Neu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8412 - 8419
• a: 12.1865 ± 0.0017 Å
• b: 11.1628 ± 0.0015 Å
• c: 13.9197 ± 0.0019 Å
• α: 90°
• β: 104.186 ± 0.002°
• γ: 90°
• Cell volume: 1835.8 ± 0.4 ų
• Cell temperature: 141 ± 2 K
• Ambient diffraction temperature: 141 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0749
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No