Information card for entry 2222986

Structure parameters

• Chemical name: 9-{4-[(<i>E</i>)-2-(4,6-Dimethyl-1,3,5-triazin-2-yl)ethenyl]phenyl}-9<i>H</i>- carbazole
• Formula: C25 H20 N4
• Calculated formula: C25 H20 N4
• SMILES: n1c(nc(nc1C)/C=C/c1ccc(n2c3ccccc3c3ccccc23)cc1)C
• Title of publication: 9-{4-[(<i>E</i>)-2-(4,6-Dimethyl-1,3,5-triazin-2-yl)ethenyl]phenyl}-9<i>H</i>-carbazole
• Authors of publication: Liu, Chang-Lin; Xue, Gang; Cui, Yue-Zhi; Li, Tian-Duo; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: o2095
• a: 8.0415 ± 0.0008 Å
• b: 15.716 ± 0.002 Å
• c: 16.098 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2034.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1105
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1596
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes