Information card for entry 7709764

Structure parameters

• Formula: C9 H8 Au Cl3 N2
• Calculated formula: C9 H8 Au Cl3 N2
• SMILES: [Au](Cl)(Cl)(Cl)[n]1cn(cc1)c1ccccc1
• Title of publication: Clinically used antifungal azoles as ligands for gold(iii) complexes: the influence of the Au(iii) ion on the antimicrobial activity of the complex
• Authors of publication: Stevanović, Nevena Lj.; Kljun, Jakob; Aleksic, Ivana; Bogojevic, Sanja Skaro; Milivojevic, Dusan; Veselinovic, Aleksandar; Turel, Iztok; Djuran, Miloš I.; Nikodinovic-Runic, Jasmina; Glišić, Biljana Đ.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 8.7297 ± 0.0005 Å
• b: 6.9516 ± 0.0003 Å
• c: 19.7326 ± 0.0011 Å
• α: 90°
• β: 102.008 ± 0.005°
• γ: 90°
• Cell volume: 1171.28 ± 0.11 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0359
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0656
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No