Information card for entry 4333557

Structure parameters

• Common name: [(SIDipp)Au(cyclooctyne)][SbF6]
• Formula: C36 H52 Au Cl2 F6 N2 Sb
• Calculated formula: C36 H52 Au Cl2 F6 N2 Sb
• Title of publication: End-On and Side-On π-Acid Ligand Adducts of Gold(I): Carbonyl, Cyanide, Isocyanide, and Cyclooctyne Gold(I) Complexes Supported by N-Heterocyclic Carbenes and Phosphines
• Authors of publication: Mehmet Ali Celik; Chandrakanta Dash; Venkata A. K. Adiraju; Animesh Das; Muhammed Yousufuddin; Gernot Frenking; H. V. Rasika Dias
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 729 - 742
• a: 14.1827 ± 0.0009 Å
• b: 14.4496 ± 0.0009 Å
• c: 22.4045 ± 0.0011 Å
• α: 90°
• β: 120.917 ± 0.003°
• γ: 90°
• Cell volume: 3939.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0424
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No