Information card for entry 2223803

Structure parameters

• Chemical name: [(<i>Z</i>)-<i>O</i>-Ethyl <i>N</i>-(4-nitrophenyl)thiocarbamato-κ<i>S</i>](triphenylphosphine- κ<i>P</i>)gold(I) dichloromethane solvate
• Formula: C28 H26 Au Cl2 N2 O3 P S
• Calculated formula: C28 H26 Au Cl2 N2 O3 P S
• SMILES: [Au](SC(=N\c1ccc(N(=O)=O)cc1)/OCC)[P](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl
• Title of publication: [(<i>Z</i>)-<i>O</i>-Ethyl <i>N</i>-(4-nitrophenyl)thiocarbamato-κ<i>S</i>](triphenylphosphine-κ<i>P</i>)gold(I) dichloromethane solvate
• Authors of publication: Ho, Soo Yei; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1468
• a: 8.7525 ± 0.0007 Å
• b: 11.1373 ± 0.0009 Å
• c: 15.8981 ± 0.0013 Å
• α: 104.311 ± 0.002°
• β: 105.559 ± 0.002°
• γ: 91.775 ± 0.002°
• Cell volume: 1438.7 ± 0.2 ų
• Cell temperature: 238 ± 2 K
• Ambient diffraction temperature: 238 ± 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: 0.065
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes