Information card for entry 7116712

Structure parameters

• Chemical name: [Au(BAC)2][OTf]
• Formula: C31 H56 Au F3 N4 O3 S
• Calculated formula: C31 H56 Au F3 N4 O3 S
• Title of publication: A simple access to transition metal cyclopropenylidene complexes
• Authors of publication: Yannick D. Bidal; Mathieu Lesieur; Mohand Melaimi; David B. Cordes; Alexandra M. Z. Slawin; Guy Bertrand; Catherine S. J. Cazin
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 4778
• a: 13.2941 ± 0.0006 Å
• b: 9.5096 ± 0.0005 Å
• c: 14.5324 ± 0.0007 Å
• α: 90°
• β: 93.61 ± 0.002°
• γ: 90°
• Cell volume: 1833.56 ± 0.15 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0441
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.201
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No