Information card for entry 2229603

Structure parameters

• Common name: 2-amino-6-(naphthalen-1-yl)-4-phenylnicotinonitrile
• Chemical name: 2-Amino-6-(naphthalen-1-yl)-4-phenylpyridine-3-carbonitrile
• Formula: C22 H15 N3
• Calculated formula: C22 H15 N3
• SMILES: n1c(cc(c2ccccc2)c(c1N)C#N)c1c2ccccc2ccc1
• Title of publication: 2-Amino-6-(naphthalen-1-yl)-4-phenylpyridine-3-carbonitrile
• Authors of publication: Mao, Wei; Guo, Cheng; Wang, Wei; Luan, Chang-jun; Du, Ren-jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 4
• Pages of publication: o853
• a: 11.799 ± 0.002 Å
• b: 17.284 ± 0.003 Å
• c: 17.492 ± 0.004 Å
• α: 90°
• β: 98.26 ± 0.03°
• γ: 90°
• Cell volume: 3530.2 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1534
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1307
• Weighted residual factors for all reflections included in the refinement: 0.1795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes