Information card for entry 7128303

Structure parameters

• Formula: C54 H52 N6 O12
• Calculated formula: C54 H52 N6 O12
• Title of publication: 2D hydrogen-bonded organic frameworks: in-site generation and subsequent exfoliation.
• Authors of publication: Luo, Yang-Hui; Zhang, Lan; Fang, Wen-Xia; Ma, Shu-Hua; Dong, Hui; Su, Shan; Zheng, Zi-Yue; Li, Di-Ning; Zhai, Li-Hai
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 48
• Pages of publication: 5901 - 5904
• a: 13.3968 ± 0.0004 Å
• b: 18.0672 ± 0.0004 Å
• c: 11.3731 ± 0.0003 Å
• α: 90°
• β: 100.927 ± 0.003°
• γ: 90°
• Cell volume: 2702.87 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1744
• Residual factor for significantly intense reflections: 0.1695
• Weighted residual factors for significantly intense reflections: 0.4806
• Weighted residual factors for all reflections included in the refinement: 0.496
• Goodness-of-fit parameter for all reflections included in the refinement: 2.495
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No