Information card for entry 1576038

Structure parameters

• Formula: C84 H72 N6 O6
• Calculated formula: C84 H72 N6 O6
• Title of publication: Chiral tether-guided selective synthesis of <i>D</i> _<i>n</i> -symmetric chiral conjugated nanorings.
• Authors of publication: An, Tai; Yao, Jiayao; Xiao, Zuo; Yu, Qi; Wang, Yu; Gao, Yueyue; Song, Yixiao; Huang, Zuoxin; Ding, Zheng; Zhang, Xinyue; Xie, Yuanpeng; Lv, Menglan; Zuo, Chuantian; Ding, Junqiao; Ding, Liming
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 45
• Pages of publication: 21404 - 21415
• a: 17.728 ± 0.002 Å
• b: 17.892 ± 0.002 Å
• c: 19.632 ± 0.002 Å
• α: 65.98 ± 0.005°
• β: 81.665 ± 0.006°
• γ: 77.601 ± 0.006°
• Cell volume: 5543.6 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.183
• Residual factor for significantly intense reflections: 0.0897
• Weighted residual factors for significantly intense reflections: 0.2333
• Weighted residual factors for all reflections included in the refinement: 0.286
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No