Information card for entry 7027224

Structure parameters

• Formula: C5 H9 Au Cl3 O P S
• Calculated formula: C5 H9 Au Cl3 O P S
• SMILES: [Au](SC(=O)C(Cl)(Cl)Cl)[P](C)(C)C
• Title of publication: (Phosphine)gold(I) trifluoromethanesulfonates, trifluoroacetates and trichlorothioacetates †
• Authors of publication: Preisenberger, Max; Schier, Annette; Schmidbaur, Hubert
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 10
• Pages of publication: 1645
• a: 6.208 ± 0.001 Å
• b: 10.216 ± 0.001 Å
• c: 19.18 ± 0.002 Å
• α: 90°
• β: 98.7 ± 0.01°
• γ: 90°
• Cell volume: 1202.4 ± 0.3 ų
• Cell temperature: 163.15 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections: 0.1618
• Weighted residual factors for significantly intense reflections: 0.1207
• Goodness-of-fit parameter for all reflections: 1.196
• Goodness-of-fit parameter for significantly intense reflections: 1.244
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No