Information card for entry 1557668

Structure parameters

• Formula: C15 H9 F2 N O
• Calculated formula: C15 H9 F2 N O
• SMILES: Fc1cc(F)c(/C=C/c2oc3ccccc3n2)cc1
• Title of publication: “Living” luminogens: light driven ACQ-to-AIE transformation accompanied with solid-state actuation
• Authors of publication: Wang, Haoran; Xing, Hao; Gong, Junyi; Zhang, Haoke; Zhang, Jun; Wei, Peifa; Yang, Guojian; Lam, Jacky W. Y.; Lu, Ran; Tang, Ben Zhong
• Journal of publication: Materials Horizons
• Year of publication: 2020
• Journal volume: 7
• Journal issue: 6
• Pages of publication: 1566 - 1572
• a: 3.8629 ± 0.0002 Å
• b: 11.5405 ± 0.0007 Å
• c: 13.9513 ± 0.0007 Å
• α: 74.149 ± 0.002°
• β: 82.55 ± 0.002°
• γ: 87.829 ± 0.002°
• Cell volume: 593.24 ± 0.06 ų
• Cell temperature: 199 ± 2 K
• Ambient diffraction temperature: 199 ± 2 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: 0.065
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No