Information card for entry 4337580

Structure parameters

• Formula: C18 H54 Ce F N3 Si6
• Calculated formula: C18 H54 Ce F N3 Si6
• SMILES: [Ce](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)F
• Title of publication: Synthesis, bonding, and reactivity of a cerium(IV) fluoride complex.
• Authors of publication: Williams, Ursula J.; Robinson, Jerome R.; Lewis, Andrew J.; Carroll, Patrick J.; Walsh, Patrick J.; Schelter, Eric J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 27 - 29
• a: 22.7206 ± 0.0016 Å
• b: 15.0666 ± 0.001 Å
• c: 21.6657 ± 0.0013 Å
• α: 90°
• β: 118.189 ± 0.004°
• γ: 90°
• Cell volume: 6537 ± 0.8 ų
• Cell temperature: 100 ± 1 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: 0.0925
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No