Information card for entry 7110425

Structure parameters

• Formula: C27 H27 F15 N3 Si3 Sm
• Calculated formula: C27 H24 F15 N3 Si3 Sm
• SMILES: [Sm]123(N(c4c([F]1)c(F)c(F)c(F)c4F)[Si](C)(C)C)(N(c1c([F]2)c(F)c(F)c(F)c1F)[Si](C)(C)C)N(c1c([F]3)c(F)c(F)c(F)c1F)[Si](C)(C)C
• Title of publication: Highly electrophilic lanthanide complexes containing fluorinated amido ligands: multiple Ln···F interactions, agostic interactions and η6-arene coordination
• Authors of publication: Click, Damon R.; Scott, Brian L.; Watkin, John G.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 7
• Pages of publication: 633
• a: 10.196 ± 0.004 Å
• b: 10.868 ± 0.004 Å
• c: 16.461 ± 0.007 Å
• α: 94.96 ± 0.01°
• β: 107.33 ± 0.01°
• γ: 95.26 ± 0.01°
• Cell volume: 1721.4 ± 1.2 ų
• Cell temperature: 198 K
• Ambient diffraction temperature: 198 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: 0.0812
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections: 0.1528
• Weighted residual factors for significantly intense reflections: 0.1359
• Goodness-of-fit parameter for all reflections: 1.067
• Goodness-of-fit parameter for significantly intense reflections: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No