Information card for entry 4065625

Structure parameters

• Formula: C24 H31 Au F3 I N2 O3 S
• Calculated formula: C24 H31 Au F3 I N2 O3 S
• SMILES: [Au]1([N](=C(C(I)C(=[N]1c1c(cccc1C)C)C)C)c1c(cccc1C)C)(C)C.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: (β-Diketiminato)dimethylgold(III): Synthesis, Structure, and Reactivity
• Authors of publication: Venugopal, Ajay; Ghosh, Manik Kumer; Jürgens, Hannes; Törnroos, Karl W.; Swang, Ole; Tilset, Mats; Heyn, Richard H.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 10
• Pages of publication: 2248
• a: 11.1621 ± 0.0008 Å
• b: 12.896 ± 0.0009 Å
• c: 19.3602 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2786.8 ± 0.3 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 8
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0142
• Residual factor for significantly intense reflections: 0.0139
• Weighted residual factors for significantly intense reflections: 0.0401
• Weighted residual factors for all reflections included in the refinement: 0.0402
• Goodness-of-fit parameter for all reflections included in the refinement: 0.912
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No