Information card for entry 4067255

Structure parameters

• Formula: C42 H52 N2 O U
• Calculated formula: C42 H52 N2 O U
• SMILES: [U]12(N(CC[O]2CCN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)(Cc1ccccc1)Cc1ccccc1
• Title of publication: Diamido-Ether Uranium(IV) Alkyl Complexes as Single-Component Ethylene Polymerization Catalysts
• Authors of publication: Hayes, Cassandra E.; Leznoff, Daniel B.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 4
• Pages of publication: 767
• a: 12.632 ± 0.002 Å
• b: 17.049 ± 0.003 Å
• c: 19.903 ± 0.004 Å
• α: 79.476 ± 0.003°
• β: 78.511 ± 0.003°
• γ: 73.126 ± 0.003°
• Cell volume: 3983.9 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 293 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: 0.2002
• Residual factor for significantly intense reflections: 0.0704
• Weighted residual factors for all reflections: 0.1152
• Weighted residual factors for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2618
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No