Information card for entry 7245037

Structure parameters

• Formula: C47 H38 O4
• Calculated formula: C47 H38 O4
• SMILES: O=C(/C(c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1)=C(/C=C/c1ccc(OC)cc1)O)/C=C/c1ccc(OC)cc1
• Title of publication: A curcumin-based AIEE-active fluorescent probe for Cu2+ detection in aqueous solution
• Authors of publication: Lin, Yang; Yu, Ao; Wang, Jinjing; Kong, Derui; Liu, Hongtao; Li, Jianwei; Jia, Chunman
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 26
• Pages of publication: 16772 - 16778
• a: 11.3529 ± 0.0009 Å
• b: 13.0942 ± 0.0011 Å
• c: 13.9528 ± 0.0012 Å
• α: 63.486 ± 0.005°
• β: 77.327 ± 0.006°
• γ: 78.923 ± 0.006°
• Cell volume: 1800.2 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.2143
• Weighted residual factors for all reflections included in the refinement: 0.2316
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No