Information card for entry 4347917

Structure parameters

• Formula: C27 H39 Ce F3 N3 Si3
• Calculated formula: C27 H39 Ce F3 N3 Si3
• SMILES: [Ce]123(N([Si](C)(C)C)c4c(cccc4)[F]1)(N([Si](C)(C)C)c1c(cccc1)[F]2)N([Si](C)(C)C)c1c(cccc1)[F]3
• Title of publication: Cerium(III) and Uranium(IV) Complexes of the 2-Fluorophenyl Trimethylsilyl Amide Ligand: C-F →Ln/An Interactions that Modulate the Coordination Spheres of f-Block Elements.
• Authors of publication: Yin, Haolin; Carroll, Patrick J.; Schelter, Eric J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 11
• Pages of publication: 5684 - 5692
• a: 10.4413 ± 0.0004 Å
• b: 11.5353 ± 0.0005 Å
• c: 26.7685 ± 0.0012 Å
• α: 90°
• β: 90.139 ± 0.002°
• γ: 90°
• Cell volume: 3224.1 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0243
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0775
• Goodness-of-fit parameter for all reflections included in the refinement: 1.337
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No