Information card for entry 1575979

Structure parameters

• Formula: C89 H140 I N2 U3
• Calculated formula: C89 H140 I N2 U3
• Title of publication: Room temperature dinitrogen cleavage and hydrogenation with organometallic complexes of uranium.
• Authors of publication: Shephard, Angus C. G.; Pedussaut, Lucie; De Marchi, Linda; Demonti, Luca; Rajeshkumar, Thayalan; Casaretto, Nicolas; Maron, Laurent; Danoun, Grégory; Simler, Thomas; Nocton, Grégory
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 45
• Pages of publication: 21334 - 21345
• a: 14.0922 ± 0.0003 Å
• b: 14.3701 ± 0.0003 Å
• c: 23.5776 ± 0.0005 Å
• α: 77.506 ± 0.002°
• β: 82.208 ± 0.002°
• γ: 65.737 ± 0.002°
• Cell volume: 4243.94 ± 0.17 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0375
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No