Information card for entry 4025832

Structure parameters

• Formula: C14 H27 Au F6 N O4 P S2
• Calculated formula: C14 H27 Au F6 N O4 P S2
• SMILES: [Au](N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Gold(I) Catalyzes the Intermolecular Hydroamination of Alkynes with Imines and Produces α,α',N-Triarylbisenamines: Studies on Their Use As Intermediates in Synthesis
• Authors of publication: Antonio Leyva-Pérez; Jose R. Cabrero-Antonino; Ángel Cantín; Avelino Corma
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2010
• Journal volume: 75
• Pages of publication: 7769 - 7780
• a: 26.634 ± 0.0005 Å
• b: 11.4521 ± 0.0002 Å
• c: 15.097 ± 0.0003 Å
• α: 90°
• β: 104.782 ± 0.001°
• γ: 90°
• Cell volume: 4452.41 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0239
• Residual factor for significantly intense reflections: 0.0176
• Weighted residual factors for significantly intense reflections: 0.0362
• Weighted residual factors for all reflections included in the refinement: 0.0374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No