Information card for entry 4307425

Structure parameters

• Formula: C12 H12 Au Cl F6 N3 P
• Calculated formula: C12 H12 Au Cl F6 N3 P
• SMILES: [Au]12(Cl)[n]3ccccc3CN1Cc1cccc[n]21.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond
• Authors of publication: Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 1361 - 1368
• a: 7.1133 ± 0.0008 Å
• b: 9.2737 ± 0.0013 Å
• c: 13.218 ± 0.002 Å
• α: 108.123 ± 0.005°
• β: 97.509 ± 0.007°
• γ: 102.762 ± 0.007°
• Cell volume: 789.3 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0816
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1143
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No