Information card for entry 4069310

Structure parameters

• Formula: C33 H48 N2 U
• Calculated formula: C33 H48 N2 U
• SMILES: [U]123456789(N(C(C)C)/C(=N/C(C)C)c%10c1cccc%10)([c]1([c]2([c]3([c]4([c]51C)C)C)C)C)[c]1([c]6([c]7([c]8([c]91C)C)C)C)C
• Title of publication: Insertion of Carbodiimides and Organic Azides into Actinide−Carbon Bonds
• Authors of publication: Evans, William J.; Walensky, Justin R.; Ziller, Joseph W.; Rheingold, Arnold L.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 12
• Pages of publication: 3350
• a: 10.0405 ± 0.0006 Å
• b: 16.7741 ± 0.001 Å
• c: 17.8447 ± 0.0011 Å
• α: 90°
• β: 92.78 ± 0.001°
• γ: 90°
• Cell volume: 3001.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0289
• Residual factor for significantly intense reflections: 0.0217
• Weighted residual factors for significantly intense reflections: 0.0504
• Weighted residual factors for all reflections included in the refinement: 0.0535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No