Information card for entry 7108979

Structure parameters

• Formula: C48 H40 N4 O10 P2 U
• Calculated formula: C48 H40 N4 O10 P2 U
• SMILES: [U]12(ON=O)(=O)(=O)(ON=[O]1)(ON=[O]2)ON=O.c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Nitrite complexes of uranium and thorium
• Authors of publication: Florian Dulong; Jacky Pouessel; Pierre Thuery; Jean-Claude Berthet; Michel Ephritikhine; Thibault Cantat
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 2412
• a: 10.0718 ± 0.0002 Å
• b: 10.7528 ± 0.0002 Å
• c: 11.7809 ± 0.0003 Å
• α: 99.5411 ± 0.0007°
• β: 93.7891 ± 0.0007°
• γ: 114.61 ± 0.0009°
• Cell volume: 1130.86 ± 0.04 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0239
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for significantly intense reflections: 0.0513
• Weighted residual factors for all reflections included in the refinement: 0.0514
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No