Information card for entry 4088919

Structure parameters

• Formula: C62 H60 Cl2 F73 K O18 Si8
• Calculated formula: C62 H60 Cl2 F73 K O18 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: 13.8521 ± 0.0005 Å
• b: 14.5848 ± 0.0005 Å
• c: 14.9006 ± 0.001 Å
• α: 69.641 ± 0.005°
• β: 83.129 ± 0.006°
• γ: 61.922 ± 0.004°
• Cell volume: 2486.6 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1351
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• 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