Information card for entry 4337246

Structure parameters

• Formula: C26 H20 Au N2 P S2
• Calculated formula: C26 H20 Au N2 P S2
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)SC(=S)n1ncc2c1cccc2
• Title of publication: Phosphinogold(I) dithiocarbamate complexes: effect of the nature of phosphine ligand on anticancer properties.
• Authors of publication: Keter, Frankline K.; Guzei, Ilia A.; Nell, Margo; Zyl, Werner E van; Darkwa, James
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 2058 - 2067
• a: 9.1382 ± 0.0012 Å
• b: 22.487 ± 0.003 Å
• c: 11.376 ± 0.0014 Å
• α: 90°
• β: 91.541 ± 0.002°
• γ: 90°
• Cell volume: 2336.8 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0216
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No