Information card for entry 4325579

Structure parameters

• Formula: C41 H48 N2 P2 Si2 U
• Calculated formula: C41 H48 N2 P2 Si2 U
• SMILES: [U]123456789%10([N](=P(C=2P(=[N]1[Si](C)(C)C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[Si](C)(C)C)([cH]1[cH]3[cH]4[cH]5[cH]61)[cH]1[cH]7[cH]8[cH]9[cH]%101
• Title of publication: Actinide Metals with Multiple Bonds to Carbon: Synthesis, Characterization, and Reactivity of U(IV) and Th(IV) Bis(iminophosphorano)methandiide Pincer Carbene Complexes
• Authors of publication: Guibin Ma; Michael J. Ferguson; Robert McDonald; Ronald G. Cavell
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 6500 - 6508
• a: 10.229 ± 0.0006 Å
• b: 11.7512 ± 0.0007 Å
• c: 17.8708 ± 0.001 Å
• α: 74.6909 ± 0.0007°
• β: 76.9568 ± 0.0007°
• γ: 76.4559 ± 0.0007°
• Cell volume: 1983.3 ± 0.2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0493
• Weighted residual factors for all reflections included in the refinement: 0.0503
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No