Information card for entry 4082560

Structure parameters

• Formula: C29 H34 Au Cl2 F6 N3 O4 S2
• Calculated formula: C29 H34 Au Cl2 F6 N3 O4 S2
• SMILES: C1(N(C(=C(N1c1c(cccc1C(C)C)C(C)C)Cl)Cl)c1c(cccc1C(C)C)C(C)C)=[Au]N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
• Title of publication: New [Au(NHC)(OH)] Complexes for Silver-Free Protocols
• Authors of publication: Patrick, Scott R.; Gómez-Suárez, Adrián; Slawin, Alexandra M. Z.; Nolan, Steven P.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 1
• Pages of publication: 421
• a: 10.958 ± 0.003 Å
• b: 19.591 ± 0.005 Å
• c: 16.703 ± 0.005 Å
• α: 90°
• β: 101.715 ± 0.006°
• γ: 90°
• Cell volume: 3511.1 ± 1.7 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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 significantly intense reflections: 0.0232
• Weighted residual factors for all reflections included in the refinement: 0.0377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No