Information card for entry 4323500

Structure parameters

• Chemical name: Catena-[Tetra(pentafluorophenoxy)bismuth]Sodium
• Formula: C28 H8 Bi F20 Na O5
• Calculated formula: C28 H8 Bi F20 Na O5
• SMILES: [Bi]([O]1CCCC1)(Oc1c(F)c(F)c(c(F)c1F)F)(Oc1c(c(c(c(c1F)F)F)F)F)(Oc1c(c(c(c(F)c1F)F)F)F)Oc1c(c(c(c(c1F)F)F)F)F.[Na+]
• Title of publication: Oligomerization and Oxide Formation in Bismuth Aryloxides: Synthesis, Characterization, and Structures of [NaBi(OC6F5)4(THF)]∞and Na4Bi2(μ6-O)(OC6F5)8(THF)4
• Authors of publication: Jennifer L. Jolas; Silke Hoppe; Kenton H. Whitmire
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 3335 - 3340
• a: 12.324 ± 0.002 Å
• b: 10.934 ± 0.002 Å
• c: 13.334 ± 0.003 Å
• α: 90°
• β: 91.19 ± 0.03°
• γ: 90°
• Cell volume: 1796.4 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0727
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections: 0.1821
• Weighted residual factors for significantly intense reflections: 0.1558
• Goodness-of-fit parameter for all reflections: 1.016
• Goodness-of-fit parameter for significantly intense reflections: 1.014
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No