Information card for entry 2225269

Structure parameters

• Chemical name: 3-Phenylpyridinium tetrachloridoaurate(III)
• Formula: C11 H10 Au Cl4 N
• Calculated formula: C11 H10 Au Cl4 N
• SMILES: c1c(ccc[nH+]1)c1ccccc1.[Au](Cl)(Cl)(Cl)[Cl-]
• Title of publication: 3-Phenylpyridinium tetrachloridoaurate(III)
• Authors of publication: Amani, Vahid; Safari, Nasser; Khavasi, Hamid Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m345
• a: 7.7629 ± 0.0009 Å
• b: 8.5901 ± 0.0011 Å
• c: 11.053 ± 0.0015 Å
• α: 94.106 ± 0.011°
• β: 107.125 ± 0.01°
• γ: 97.216 ± 0.01°
• Cell volume: 694.2 ± 0.16 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0313
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0822
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes