Information card for entry 4086525

Structure parameters

• Formula: C22 H29 Ag F6 N3 O P
• Calculated formula: C22 H29 Ag F6 N3 O P
• Title of publication: Transition Metal Complexes of an (S,S)-1,2-Diphenylethylamine-Functionalized N-Heterocyclic Carbene: A New Member of the Asymmetric NHC Ligand Family
• Authors of publication: Wan, Kai Y.; Lough, Alan J.; Morris, Robert H.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 11
• Pages of publication: 1604
• a: 12.1182 ± 0.0003 Å
• b: 12.9197 ± 0.0004 Å
• c: 15.7571 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2466.99 ± 0.13 ų
• Cell temperature: 147 ± 2 K
• Ambient diffraction temperature: 147 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No