Information card for entry 7701450

Structure parameters

• Formula: C80 H76 Au4 F12 N20 O16 S4
• Calculated formula: C80 H76 Au4 F12 N20 O16 S4
• Title of publication: Synthesis, characterization, and biological studies of multidentate gold(i) and gold(iii) NHC complexes.
• Authors of publication: Bauer, Elisabeth B.; Bernd, Marco A.; Schütz, Max; Oberkofler, Jens; Pöthig, Alexander; Reich, Robert M.; Kühn, Fritz E
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• a: 12.3978 ± 0.0007 Å
• b: 12.7838 ± 0.0007 Å
• c: 16.2846 ± 0.0009 Å
• α: 67.459 ± 0.002°
• β: 85.945 ± 0.002°
• γ: 84.111 ± 0.002°
• Cell volume: 2369.8 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0627
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No