Information card for entry 7241889

Structure parameters

• Formula: C8 H6 Au Cl3 N2
• Calculated formula: C8 H6 Au Cl3 N2
• SMILES: [Au](Cl)(Cl)(Cl)[n]1c2cccnc2ccc1
• Title of publication: Mononuclear gold(iii) complexes with diazanaphthalenes: the influence of the position of nitrogen atoms in the aromatic rings on the complex crystalline properties
• Authors of publication: Glišić, Biljana Đ.; Warżajtis, Beata; Hoffmann, Marcin; Rychlewska, Urszula; Djuran, Miloš I.
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 72
• Pages of publication: 44481 - 44493
• a: 12.9111 ± 0.0004 Å
• b: 12.1129 ± 0.0004 Å
• c: 6.7647 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1057.94 ± 0.06 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.02
• Residual factor for significantly intense reflections: 0.0172
• Weighted residual factors for significantly intense reflections: 0.0343
• Weighted residual factors for all reflections included in the refinement: 0.0353
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No