Information card for entry 7045045

Structure parameters

• Chemical name: trisphenylbismuth-bis(S-mandelate)
• Formula: C34 H29 Bi O6
• Calculated formula: C34 H29 Bi O6
• SMILES: [Bi](OC(=O)[C@@H](O)c1ccccc1)(OC(=O)[C@@H](O)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Comparative stability, toxicity and anti-leishmanial activity of triphenyl antimony(v) and bismuth(v) α-hydroxy carboxylato complexes.
• Authors of publication: Duffin, Rebekah N.; Blair, Victoria L.; Kedzierski, Lukasz; Andrews, Philip C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 3
• Pages of publication: 971 - 980
• a: 10.2304 ± 0.0003 Å
• b: 11.9959 ± 0.0005 Å
• c: 23.2353 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2851.5 ± 0.18 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0362
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0499
• Weighted residual factors for all reflections included in the refinement: 0.0526
• Goodness-of-fit parameter for all reflections included in the refinement: 0.877
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No