Information card for entry 7249152

Structure parameters

• Formula: C8 H13 B F4 N2 O2
• Calculated formula: C8 H13 B F4 N2 O2
• 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: 8.1082 ± 0.0007 Å
• b: 8.1979 ± 0.001 Å
• c: 9.6164 ± 0.0011 Å
• α: 79.2 ± 0.01°
• β: 88.373 ± 0.008°
• γ: 66.083 ± 0.01°
• Cell volume: 573.16 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1366
• Residual factor for significantly intense reflections: 0.102
• Weighted residual factors for significantly intense reflections: 0.2657
• Weighted residual factors for all reflections included in the refinement: 0.2979
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No