Information card for entry 2226219

Structure parameters

• Chemical name: [(<i>Z</i>)-<i>O</i>-Methyl <i>N</i>-(3-chlorophenyl)thiocarbamato- κ<i>S</i>](triphenylphosphine-κ<i>P</i>)gold(I)
• Formula: C26 H22 Au Cl N O P S
• Calculated formula: C26 H22 Au Cl N O P S
• SMILES: [Au](SC(=N\c1cc(Cl)ccc1)/OC)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: [(<i>Z</i>)-<i>O</i>-Methyl <i>N</i>-(3-chlorophenyl)thiocarbamato-κ<i>S</i>](triphenylphosphine-κ<i>P</i>)gold(I)
• Authors of publication: Tadbuppa, Primjira P.; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: m664
• a: 10.4236 ± 0.0008 Å
• b: 10.6961 ± 0.0008 Å
• c: 12.7439 ± 0.0009 Å
• α: 72.724 ± 0.002°
• β: 66.105 ± 0.001°
• γ: 72.53 ± 0.002°
• Cell volume: 1213.83 ± 0.16 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes