Information card for entry 7228959

Structure parameters

• Formula: C20 H20 F2 N2 O2
• Calculated formula: C20 H20 F2 N2 O2
• SMILES: Oc1c(cccc1F)/C=N/[C@H]1CCCC[C@@H]1/N=C/c1cccc(F)c1O.Oc1c(cccc1F)/C=N/[C@@H]1CCCC[C@H]1/N=C/c1cccc(F)c1O
• Title of publication: Chiral and non-conjugated fluorescent salen ligands: AIE, anion probes, chiral recognition of unprotected amino acids, and cell imaging applications
• Authors of publication: Shen, Guangyu; Gou, Fei; Cheng, Jinghui; Zhang, Xiaohong; Zhou, Xiangge; Xiang, Haifeng
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 64
• Pages of publication: 40640
• a: 10.4661 ± 0.0004 Å
• b: 11.0082 ± 0.0005 Å
• c: 17.6201 ± 0.0005 Å
• α: 95.216 ± 0.003°
• β: 96.508 ± 0.003°
• γ: 110.291 ± 0.004°
• Cell volume: 1873.25 ± 0.14 ų
• Cell temperature: 293.28 ± 0.1 K
• Ambient diffraction temperature: 293.28 ± 0.1 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: 0.0605
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1518
• Weighted residual factors for all reflections included in the refinement: 0.1621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No