Information card for entry 7048997

Structure parameters

• Formula: C12 H9 Au Cl3 N O
• Calculated formula: C12 H9 Au Cl3 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: 22.5415 ± 0.0011 Å
• b: 7.6492 ± 0.0003 Å
• c: 16.1518 ± 0.0007 Å
• α: 90°
• β: 95.509 ± 0.005°
• γ: 90°
• Cell volume: 2772.1 ± 0.2 ų
• Cell temperature: 183 ± 1 K
• Ambient diffraction temperature: 183 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0271
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.0521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No