Information card for entry 7235674

Structure parameters

• Formula: C23 H23 N O3
• Calculated formula: C23 H23 N O3
• Title of publication: Reversible piezofluorochromic nature and mechanism of aggregation-induced emission-active compounds based on simple modification
• Authors of publication: Cao, Yuanle; Xi, Wengang; Wang, Lianke; Wang, Huizhen; Kong, Lin; Zhou, Hongping; Wu, Jieying; Tian, Yupeng
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 47
• Pages of publication: 24649
• a: 14.6029 ± 0.0019 Å
• b: 7.8062 ± 0.001 Å
• c: 17.686 ± 0.002 Å
• α: 90°
• β: 97.712 ± 0.001°
• γ: 90°
• Cell volume: 1997.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0544
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1208
• Weighted residual factors for all reflections included in the refinement: 0.1291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No