Information card for entry 7241888

Structure parameters

• Formula: C8 H6 Au Cl3 N2
• Calculated formula: C8 H6 Au Cl3 N2
• SMILES: n1c[n](cc2c1cccc2)[Au](Cl)(Cl)Cl
• 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: 7.6012 ± 0.0004 Å
• b: 7.6086 ± 0.0005 Å
• c: 9.9648 ± 0.0004 Å
• α: 111.477 ± 0.005°
• β: 92.248 ± 0.004°
• γ: 92.294 ± 0.005°
• Cell volume: 534.96 ± 0.05 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0217
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0436
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No