Information card for entry 7246286

Structure parameters

• Formula: C24 H16 F5 O2 P
• Calculated formula: C24 H16 F5 O2 P
• Title of publication: Defluorophosphorylation of fluoroalkyl peroxides for the synthesis of highly substituted furans
• Authors of publication: Chu, Xue-Qiang; Cai, Song-Zhou; Chen, Jia-Wei; Yu, Zi-Lun; Ma, Mengtao; Walsh, Patrick J.; Shen, Zhi-Liang
• Journal of publication: Green Chemistry
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 5
• Pages of publication: 2000 - 2010
• a: 18.8874 ± 0.0014 Å
• b: 6.1813 ± 0.0005 Å
• c: 17.2323 ± 0.0011 Å
• α: 90°
• β: 91.402 ± 0.006°
• γ: 90°
• Cell volume: 2011.2 ± 0.3 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.1029
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No