Information card for entry 1574502

Structure parameters

• Formula: C22 H22 N2
• Calculated formula: C22 H22 N2
• SMILES: C(=C\C=C(C)\C=N\c1ccccc1)/C=C(C)/C=N/c1ccccc1
• Title of publication: Impact of imine bonds on the electronic properties of degradable carotenoid-based conjugated polymers
• Authors of publication: Uva, Azalea; Kim, Yaejin; Michailovich, Sofia; Hsu, Nathan S. Y.; Bain, David C.; Huang, Shine H.; Musser, Andrew J.; Tran, Helen
• Journal of publication: Polymer Chemistry
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 24
• Pages of publication: 2817 - 2828
• a: 6.3548 ± 0.001 Å
• b: 7.1946 ± 0.0012 Å
• c: 19.21 ± 0.003 Å
• α: 90°
• β: 91.006 ± 0.006°
• γ: 90°
• Cell volume: 878.2 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• 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: 0.0425
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No