Information card for entry 1550847

Structure parameters

• Formula: C29 H24 N2 O2
• Calculated formula: C29 H24 N2 O2
• SMILES: O(c1ccc(N(c2ccc(/C=C(/c3ccccc3)C#N)cc2)c2ccc(OC)cc2)cc1)C
• Title of publication: Substituent effects of AIE-active α-cyanostilbene-containing triphenylamine derivatives on electrofluorochromic behavior.
• Authors of publication: Chen, Sin-Yu; Chiu, Ya-Wen; Liou, Guey-Sheng
• Journal of publication: Nanoscale
• Year of publication: 2019
• Journal volume: 11
• Journal issue: 17
• Pages of publication: 8597 - 8603
• a: 10.8798 ± 0.0004 Å
• b: 11.8215 ± 0.0004 Å
• c: 35.5224 ± 0.0013 Å
• α: 90°
• β: 90.737 ± 0.004°
• γ: 90°
• Cell volume: 4568.4 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• 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: 0.0842
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No