Information card for entry 7041775

Structure parameters

• Formula: C16 H18 F6 Si3
• Calculated formula: C16 H18 F6 Si3
• SMILES: [Si](CC[Si](F)(F)F)(CC[Si](F)(F)F)(c1ccccc1)c1ccccc1
• Title of publication: Fluoride complexation by bidentate silicon Lewis acids.
• Authors of publication: Horstmann, Jan; Niemann, Mark; Berthold, Katarína; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 6
• Pages of publication: 1898 - 1913
• a: 9.58517 ± 0.0001 Å
• b: 15.67457 ± 0.00013 Å
• c: 13.23279 ± 0.00017 Å
• α: 90°
• β: 109.178 ± 0.0012°
• γ: 90°
• Cell volume: 1877.81 ± 0.04 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0288
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections included in the refinement: 0.0711
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No