Information card for entry 7160043

Structure parameters

• Formula: C26 H21 Bi Cl N S
• Calculated formula: C26 H21 Bi Cl N S
• Title of publication: Facile synthesis and antifungal evaluation of hypervalent organoantimony(III) and -bismuth(III) thioates with tridentate C,N,C-coordinating ligands
• Authors of publication: Wang, Zixiu; Huang, Yan; Deng, Dandan; Li, Shan; Yu, Yimei; Ye, Yifei; Chen, Yi; Lei, Jian
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2024
• a: 7.806 ± 0.0001 Å
• b: 13.5247 ± 0.0001 Å
• c: 21.4223 ± 0.0002 Å
• α: 90°
• β: 96.214 ± 0.001°
• γ: 90°
• Cell volume: 2248.35 ± 0.04 ų
• Cell temperature: 293 ± 0.1 K
• Ambient diffraction temperature: 293 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.028
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No