Information card for entry 4088916

Structure parameters

• Formula: C52 H80 F K O34 Si8
• Calculated formula: C52 H80 F K O34 Si8
• Title of publication: Synthesis and Structures of Novel Molecular Ionic Compounds Based on Encapsulation of Anions and Cations
• Authors of publication: El Aziz, Youssef; Taylor, Peter G.; Bassindale, Alan R.; Coles, Simon J.; Pitak, Mateusz B.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 24
• Pages of publication: 4004
• a: 8.445 ± 0.003 Å
• b: 14.704 ± 0.005 Å
• c: 16.727 ± 0.005 Å
• α: 73.882 ± 0.013°
• β: 79.293 ± 0.013°
• γ: 88.688 ± 0.014°
• Cell volume: 1959.8 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0837
• Residual factor for significantly intense reflections: 0.0729
• Weighted residual factors for significantly intense reflections: 0.1979
• Weighted residual factors for all reflections included in the refinement: 0.2067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No