Information card for entry 1554693

Structure parameters

• Formula: C17 H19 N O2
• Calculated formula: C17 H19 N O2
• SMILES: O(c1ccc(/N=C/c2c(O)cccc2)cc1)CCCC
• Title of publication: Utilizing the aggregation-induced emission phenomenon to visualize spontaneous molecular directed motion in the solid state
• Authors of publication: Liu, Jianxun; Xing, Chang; Wei, Donghui; Deng, Qianqian; Yang, Cuiping; Peng, Qiuchen; Hou, Hongwei; Li, Yuanyuan; Li, Kai
• Journal of publication: Materials Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 3
• Journal issue: 12
• Pages of publication: 2746
• a: 6.1745 ± 0.0002 Å
• b: 7.0411 ± 0.0002 Å
• c: 33.2296 ± 0.001 Å
• α: 86.545 ± 0.002°
• β: 84.929 ± 0.002°
• γ: 89.992 ± 0.002°
• Cell volume: 1436.38 ± 0.08 ų
• Cell temperature: 99.9 ± 0.2 K
• Ambient diffraction temperature: 99.9 ± 0.2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0603
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.1306
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No