Information card for entry 7122282

Structure parameters

• Formula: C154 H212 O12 Se4 U2
• Calculated formula: C132 H180 O12 Se4 U2
• Title of publication: Structure and properties of [(4,6-^tBu₂C₆H₂O)₂Se]₂An(THF)₂, An = U, Np, and their reaction with p-benzoquinone.
• Authors of publication: Myers, Alexander J.; Rungthanaphatsophon, Pokpong; Behrle, Andrew C.; Vilanova, Sean P.; Kelley, Stephen P.; Lukens, Wayne W.; Walensky, Justin R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 74
• Pages of publication: 10435 - 10438
• a: 14.3383 ± 0.0009 Å
• b: 14.4734 ± 0.0009 Å
• c: 21.5834 ± 0.0019 Å
• α: 102.642 ± 0.001°
• β: 98.558 ± 0.001°
• γ: 114.946 ± 0.001°
• Cell volume: 3812.7 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.0489
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No