Information card for entry 2016187

Structure parameters

• Common name: 2,6-bis(azaindole)pyridine
• Chemical name: 2,6-bis(1H-pyrrolo[2,3-b]pyridin-1-yl)pyridine
• Formula: C19 H13 N5
• Calculated formula: C19 H13 N5
• SMILES: n1cccc2c1n(cc2)c1nc(n2ccc3c2nccc3)ccc1
• Title of publication: 2,6-Bis(azaindole)pyridine: reactivity with iron(III) and copper(II) salts
• Authors of publication: Collins, Sibrina N.; Taylor, Stephen; Krause, Jeanette A.; Connick, William B.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m436 - m439
• a: 6.6377 ± 0.0002 Å
• b: 10.1397 ± 0.0003 Å
• c: 21.9214 ± 0.0006 Å
• α: 76.609 ± 0.001°
• β: 86.563 ± 0.01°
• γ: 90.004 ± 0.001°
• Cell volume: 1432.56 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.054
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1149
• Weighted residual factors for all reflections included in the refinement: 0.1221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes