Information card for entry 7014187

Structure parameters

• Formula: C18 H15 Au I3 P
• Calculated formula: C18 H15 Au I3 P
• SMILES: [Au](I)[P](c1ccccc1)(c1ccccc1)c1ccccc1.II
• Title of publication: Governing the oxidative addition of iodine to gold(I) complexes by ligand tuning.
• Authors of publication: Schneider, Daniel; Schier, Annette; Schmidbaur, Hubert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 13
• Pages of publication: 1995 - 2005
• a: 10.214 ± 0.0001 Å
• b: 12.5045 ± 0.0001 Å
• c: 16.7349 ± 0.0002 Å
• α: 90°
• β: 105.354 ± 0.001°
• γ: 90°
• Cell volume: 2061.11 ± 0.04 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 5
• 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: 0.0261
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0663
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.262
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No