Information card for entry 8105878

Structure parameters

• Formula: C18 H12 N2
• Calculated formula: C18 H12 N2
• Title of publication: Crystal structure of 2-(naphthalen-2-yl)-1,8-naphthyridine, C18H12N2
• Authors of publication: Jia, Guo-Kai; Xiu-Wen, Chen; Jing-Kun, Lv; Chen, Xiao-Ming
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 5
• Pages of publication: 873 - 874
• a: 27.514 ± 0.005 Å
• b: 6.3231 ± 0.0011 Å
• c: 7.4175 ± 0.0013 Å
• α: 90°
• β: 95.805 ± 0.002°
• γ: 90°
• Cell volume: 1283.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.0561
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No