Information card for entry 4514601

Structure parameters

• Formula: C38 H32 F12 N4 P2
• Calculated formula: C38 H32 F12 N4 P2
• SMILES: C(#N)/C(=C\c1cc(c2ccc(cc2)C)c(cc1c1ccc(cc1)C)/C=C(C#N)/c1cc[n+](cc1)C)c1cc[n+](cc1)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Aggregation-Induced Emission Luminogens with the Capability of Wide Color Tuning, Mitochondrial and Bacterial Imaging, and Photodynamic Anticancer and Antibacterial Therapy.
• Authors of publication: Zhao, Na; Li, Pengfei; Zhuang, Jiabao; Liu, Yanyan; Xiao, Yuxin; Qin, Ruilin; Li, Nan
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2019
• Journal volume: 11
• Journal issue: 12
• Pages of publication: 11227 - 11237
• a: 6.8264 ± 0.0003 Å
• b: 7.7774 ± 0.0004 Å
• c: 19.185 ± 0.0009 Å
• α: 87.622 ± 0.002°
• β: 80.008 ± 0.002°
• γ: 68.976 ± 0.002°
• Cell volume: 936.1 ± 0.08 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0885
• Residual factor for significantly intense reflections: 0.086
• Weighted residual factors for significantly intense reflections: 0.2323
• Weighted residual factors for all reflections included in the refinement: 0.2343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No