Information card for entry 2007412

Structure parameters

• Chemical name: 2,4,6-Tri-2-pyridyl-1,3,5-Triazine
• Formula: C18 H12 N6
• Calculated formula: C18 H12 N6
• SMILES: n1c(nc(nc1c1ccccn1)c1ncccc1)c1ncccc1
• Title of publication: 2,4,6-Tris(2-pyridyl)-1,3,5-triazine
• Authors of publication: Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Russell, Mark L.; Madic, Charles
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 985 - 987
• a: 7.638 ± 0.008 Å
• b: 10.885 ± 0.012 Å
• c: 10.845 ± 0.012 Å
• α: 60.832 ± 0.01°
• β: 69.164 ± 0.01°
• γ: 79.24 ± 0.01°
• Cell volume: 735.7 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No