Information card for entry 7030273

Structure parameters

• Chemical name: bis(μ~2~-Fluoro)-hexafluoro-tetrakis(dimethylsulfoxide)-di-hafnium(IV)
• Formula: C8 H24 F8 Hf2 O4 S4
• Calculated formula: C8 H24 F8 Hf2 O4 S4
• SMILES: CS(=[O][Hf]1(F)(F)(F)([F][Hf](F)(F)([F]1)(F)([O]=S(C)C)[O]=S(C)C)[O]=S(C)C)C
• Title of publication: Preparation and structures of coordination complexes of the very hard Lewis acids ZrF4 and HfF4.
• Authors of publication: Benjamin, Sophie L.; Levason, William; Pugh, David; Reid, Gillian; Zhang, Wenjian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 40
• Pages of publication: 12548 - 12557
• a: 8.675 ± 0.004 Å
• b: 11.75 ± 0.004 Å
• c: 10.667 ± 0.004 Å
• α: 90°
• β: 108.269 ± 0.007°
• γ: 90°
• Cell volume: 1032.5 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0518
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1159
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No