Information card for entry 4073143

Structure parameters

• Formula: C37 H33 Bi N2 O10
• Calculated formula: C37 H33 Bi N2 O10
• SMILES: [Bi]123(OC(=O)c4c(O)cc(cc4)C)([O]=C(O1)c1c(O)cc(cc1)C)(OC(=[O]3)c1c(cc(cc1)C)O)[n]1cccc3c1c1c(ccc[n]21)cc3.OC
• Title of publication: Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes
• Authors of publication: Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 3321
• a: 29.085 ± 0.006 Å
• b: 31.861 ± 0.006 Å
• c: 14.885 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13794 ± 5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No