Information card for entry 7220689

Structure parameters

• Formula: C32 H21 N3 O
• Calculated formula: C32 H21 N3 O
• SMILES: O(c1nc(nc(n1)c1c2ccccc2cc2c1cccc2)c1c2c(cc3c1cccc3)cccc2)C
• Title of publication: Synthesis and Spectroscopic Properties of Propeller Typed 2,4,6-Tri(anthracen-9-yl)-1,3,5-triazine
• Authors of publication: Xu, Li; Wang, Pengfei; Zhang, Juanjuan; Wu, Wei; Shi, Jianwu; Yuan, Jianfang; Wang, Hua; Han, Hui
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 7.93 ± 0.003 Å
• b: 17.081 ± 0.007 Å
• c: 18.143 ± 0.006 Å
• α: 90°
• β: 104.463 ± 0.015°
• γ: 90°
• Cell volume: 2379.6 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1112
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No