Information card for entry 4065047

Structure parameters

• Common name: EM9 (Acet/Et2O)
• Formula: C24 H8 Au Cl F10 N4 O4
• Calculated formula: C24 H8 Au Cl F10 N4 O4
• SMILES: [Au](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)([n]1ccc(cc1)C#N)[n]1ccc(cc1)C#N.Cl(=O)(=O)(=O)[O-]
• Title of publication: Metal-Induced Phosphorescence in (Pentafluorophenyl)gold(III) Complexes
• Authors of publication: Bojan, Vilma R.; López-de-Luzuriaga, José M.; Manso, Elena; Monge, Miguel; Olmos, M. Elena
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 17
• Pages of publication: 4486
• a: 9.1601 ± 0.0008 Å
• b: 13.7289 ± 0.0007 Å
• c: 20.8276 ± 0.0017 Å
• α: 90°
• β: 90.209 ± 0.002°
• γ: 90°
• Cell volume: 2619.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0954
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.1899
• Weighted residual factors for all reflections included in the refinement: 0.207
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No