Information card for entry 7106237

Structure parameters

• Formula: C43 H51 Cl F15 N5 O3
• Calculated formula: C43 H46 Cl F15 N5 O3
• Title of publication: Dual-host approach for liquid–liquid extraction of potassium fluoride/chloride via formation of an integrated 1-D polymeric complex
• Authors of publication: I. Ravikumar; Subrata Saha; Pradyut Ghosh
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 4721
• a: 11.7018 ± 0.0018 Å
• b: 14.141 ± 0.002 Å
• c: 15.737 ± 0.003 Å
• α: 88.438 ± 0.006°
• β: 77.895 ± 0.005°
• γ: 74.96 ± 0.005°
• Cell volume: 2457.9 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0921
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.1437
• Weighted residual factors for all reflections included in the refinement: 0.1645
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No