Information card for entry 7049251

Structure parameters

• Chemical name: [Bi2(DMSO)6V10O28F2]3[Bi(DMSO)5]2
• Formula: C32 H96 Bi4 F3 O58 S16 V15
• Calculated formula: C32 H96 Bi4 F3 O58 S16 V15
• Title of publication: A simple one-step synthetic route to access a range of metal-doped polyoxovanadate clusters.
• Authors of publication: Lu, Haijiao; Jethwa, Rajesh B.; Jenkinson, Kellie J.; Wheatley, Andrew E. H.; Hao, Hongxun; Wright, Dominic S.; Pike, Sebastian D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 14
• Pages of publication: 4555 - 4564
• a: 13.3149 ± 0.0004 Å
• b: 34.6789 ± 0.0011 Å
• c: 23.1516 ± 0.0008 Å
• α: 90°
• β: 91.9529 ± 0.0018°
• γ: 90°
• Cell volume: 10684 ± 0.6 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.142
• Residual factor for significantly intense reflections: 0.1147
• Weighted residual factors for all reflections: 0.2658
• Weighted residual factors for significantly intense reflections: 0.252
• Weighted residual factors for all reflections included in the refinement: 0.2658
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9882
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No