Information card for entry 7249155

Structure parameters

• Formula: C15 H20 Au Cl2 F3 N4 O7 S
• Calculated formula: C15 H20 Au Cl2 F3 N4 O7 S
• Title of publication: Gold(I) and Gold(III) Carbene Complexes from the Marine Betaine Norzooanemonin: Inhibition of Thioredoxin Reductase, Anti-proliferative and Antimicrobial Activity
• Authors of publication: Mahdavi, Seyedehmahbobeh; Bockfeld, Dirk; Esarev, Igor V.; Lippmann, Petra; Frank, René; Brönstrup, Mark; Ott, Ingo; Tamm, Matthias
• Journal of publication: RSC Medicinal Chemistry
• Year of publication: 2024
• a: 9.8429 ± 0.0001 Å
• b: 10.4605 ± 0.0001 Å
• c: 12.6806 ± 0.0002 Å
• α: 82.846 ± 0.001°
• β: 85.097 ± 0.001°
• γ: 65.348 ± 0.001°
• Cell volume: 1176.57 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0889
• Residual factor for significantly intense reflections: 0.0718
• Weighted residual factors for significantly intense reflections: 0.201
• Weighted residual factors for all reflections included in the refinement: 0.2122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No