Information card for entry 7048994

Structure parameters

• Formula: C12 H7 Au Cl2 F3 N O
• Calculated formula: C12 H7 Au Cl2 F3 N O
• Title of publication: Towards blue emitting monocyclometalated gold(iii) complexes - synthesis, characterization and photophysical investigations.
• Authors of publication: Bachmann, Michael; Fessler, Reto; Blacque, Olivier; Venkatesan, Koushik
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 21
• Pages of publication: 7320 - 7330
• a: 7.3933 ± 0.0005 Å
• b: 9.672 ± 0.0007 Å
• c: 9.9155 ± 0.0006 Å
• α: 90.82 ± 0.005°
• β: 110.173 ± 0.006°
• γ: 100.635 ± 0.006°
• Cell volume: 651.77 ± 0.08 ų
• Cell temperature: 183 ± 1 K
• Ambient diffraction temperature: 183 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0384
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.0736
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No