Information card for entry 1575976

Structure parameters

• Formula: C73 H128 N2 U2
• Calculated formula: C73 H128 N2 U2
• 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: 18.4067 ± 0.0009 Å
• b: 10.3962 ± 0.0005 Å
• c: 19.3564 ± 0.0009 Å
• α: 90°
• β: 109.753 ± 0.003°
• γ: 90°
• Cell volume: 3486.1 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1211
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1438
• Weighted residual factors for all reflections included in the refinement: 0.1742
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No