Information card for entry 1575977

Structure parameters

• Formula: C89 H141 I N2 U3
• Calculated formula: C89 H141 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: 14.2226 ± 0.0004 Å
• b: 14.7263 ± 0.0003 Å
• c: 22.8579 ± 0.0006 Å
• α: 78.484 ± 0.002°
• β: 83.187 ± 0.002°
• γ: 65.206 ± 0.002°
• Cell volume: 4255.4 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150.15 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: 0.0567
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No