Information card for entry 7231401

Structure parameters

• Formula: C13 H22 F9 O15 Rb3 S3
• Calculated formula: C13 H22 F9 O15 Rb3 S3
• Title of publication: Sila-polyethers as innocent crystallization reagents for heavy alkali metal compounds
• Authors of publication: Dankert, Fabian; Heine, Johanna; Rienmüller, Julia; von Hänisch, Carsten
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 36
• Pages of publication: 5370
• a: 11.52 ± 0.004 Å
• b: 12.109 ± 0.004 Å
• c: 12.548 ± 0.003 Å
• α: 112.79 ± 0.02°
• β: 100.47 ± 0.03°
• γ: 102.1 ± 0.02°
• Cell volume: 1509.3 ± 0.9 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: 0.0481
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No