Information card for entry 1557672

Structure parameters

• Formula: C30 H18 F4 N2 O2
• Calculated formula: C30 H18 F4 N2 O2
• SMILES: Fc1ccc(c(c1)F)[C@@H]1[C@@H](c2nc3c(o2)cccc3)[C@@H](c2ccc(cc2F)F)[C@@H]1c1nc2c(o1)cccc2
• 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: 12.9258 ± 0.0002 Å
• b: 11.10764 ± 0.00016 Å
• c: 8.24353 ± 0.00013 Å
• α: 90°
• β: 101.365 ± 0.0016°
• γ: 90°
• Cell volume: 1160.36 ± 0.03 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• 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: 0.0344
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No