Information card for entry 7204188

Structure parameters

• Formula: C36 H27 N9
• Calculated formula: C36 H27 N9
• SMILES: n1ccccc1N(c1ncccc1)c1cc(N(c2ncccc2)c2ncccc2)cc(N(c2ncccc2)c2ncccc2)c1
• Title of publication: Syntheses, structures, and electroluminescence of new blue luminescent star-shaped compounds based on 1,3,5-triazine and 1,3,5-trisubstituted benzene
• Authors of publication: Pang, Jun; Tao, Ye; Freiberg, Stephan; Yang, Xiao-Ping; D'Iorio, Marie; Wang, Suning
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2002
• Journal volume: 12
• Journal issue: 2
• Pages of publication: 206
• a: 12.675 ± 0.003 Å
• b: 11.17 ± 0.002 Å
• c: 20.954 ± 0.004 Å
• α: 90°
• β: 99.638 ± 0.003°
• γ: 90°
• Cell volume: 2924.8 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1602
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 0.772
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No