Information card for entry 7024755

Structure parameters

• Formula: C12 H12 Au Cl2 F6 N2 O2 P
• Calculated formula: C12 H12 Au Cl2 F6 N2 O2 P
• SMILES: [P](F)(F)(F)(F)(F)[F-].[Au]1([n]2c(c3cc(cc[n]13)OC)cc(cc2)OC)(Cl)Cl
• Title of publication: Synthesis, characterisation and biological properties of gold(III) compounds with modified bipyridine and bipyridylamine ligands.
• Authors of publication: Casini, Angela; Diawara, Mariam Celine; Scopelliti, Rosario; Zakeeruddin, Shaik Mohammed; Grätzel, Michael; Dyson, Paul J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 9
• Pages of publication: 2239 - 2245
• a: 7.8169 ± 0.0011 Å
• b: 9.095 ± 0.0007 Å
• c: 13.1775 ± 0.0015 Å
• α: 90°
• β: 106.175 ± 0.013°
• γ: 90°
• Cell volume: 899.77 ± 0.19 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 8
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0767
• Weighted residual factors for significantly intense reflections: 0.2114
• Weighted residual factors for all reflections included in the refinement: 0.2118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.23
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No