Information card for entry 1575344

Structure parameters

• Formula: C17 H28 Cl2 F N O9
• Calculated formula: C17 H28 Cl2 F N O9
• Title of publication: Benzylamine cation-directed introduction of a polar structure in a stator-rotor crown ether system.
• Authors of publication: Liu, Feiyan; Wu, Yaozhen; Chen, Guoyong; Yan, Guobing; Li, Xiancai; Wei, Zhenhong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 73
• Pages of publication: 13928 - 13931
• a: 15.889 ± 0.0005 Å
• b: 18.3681 ± 0.0005 Å
• c: 15.115 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4411.3 ± 0.2 ų
• Cell temperature: 199.99 ± 0.1 K
• Ambient diffraction temperature: 199.99 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0628
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1431
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No