Information card for entry 2237951

Structure parameters

• Chemical name: Bis(but-2-enoato-κ<i>O</i>)triphenylbismuth(V)
• Formula: C26 H25 Bi O4
• Calculated formula: C26 H25 Bi O4
• SMILES: [Bi]12(OC(=[O]1)/C=C/C)(OC(=[O]2)/C=C/C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Bis(but-2-enoato-κ<i>O</i>)triphenylbismuth(V)
• Authors of publication: Andreev, Pavel V.; Somov, Nikolay V.; Kalistratova, Olga S.; Gushchin, Alexey V.; Chuprunov, Evgeny V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: m333
• a: 10.471 ± 0.0003 Å
• b: 10.4957 ± 0.0003 Å
• c: 11.9774 ± 0.0003 Å
• α: 84.941 ± 0.002°
• β: 83.633 ± 0.002°
• γ: 69.084 ± 0.003°
• Cell volume: 1220.32 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0228
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for all reflections included in the refinement: 0.0501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes