Information card for entry 4083488

Structure parameters

• Chemical name: triphenylbismuth bis(5-bromosalicylate)
• Formula: C32 H23 Bi Br2 O6
• Calculated formula: C32 H23 Bi Br2 O6
• SMILES: [Bi](OC(=O)c1c(O)ccc(Br)c1)(OC(=O)c1c(O)ccc(Br)c1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Facile One-Pot Synthesis of Triphenylbismuth(V) Bis(carboxylate) Complexes
• Authors of publication: Kumar, Ish; Bhattacharya, Prateek; Whitmire, Kenton H.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 11
• Pages of publication: 2906
• a: 9.0651 ± 0.0006 Å
• b: 10.7285 ± 0.0007 Å
• c: 16.4782 ± 0.0012 Å
• α: 87.118 ± 0.006°
• β: 84.411 ± 0.006°
• γ: 67.603 ± 0.005°
• Cell volume: 1474.5 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1056
• Goodness-of-fit parameter for all reflections included in the refinement: 0.816
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No