Information card for entry 1571080

Structure parameters

• Formula: C300 H380 F4 N16 O8 P8 S4
• Calculated formula: C300 H380 F4 N16 O8 P8 S4
• Title of publication: Sequential radical and cationic reactivity at separated sites within one molecule in solution.
• Authors of publication: Liu, Shihua; Li, Yinwu; Lin, Jieli; Ke, Zhuofeng; Grützmacher, Hansjörg; Su, Cheng-Yong; Li, Zhongshu
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 14
• Pages of publication: 5376 - 5384
• a: 26.0037 ± 0.0008 Å
• b: 13.0979 ± 0.0003 Å
• c: 40.762 ± 0.0009 Å
• α: 90°
• β: 95.402 ± 0.002°
• γ: 90°
• Cell volume: 13821.6 ± 0.6 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0995
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.198
• Weighted residual factors for all reflections included in the refinement: 0.2158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No