Information card for entry 2000922

Structure parameters

• Formula: C21 H13 Br2 N3
• Calculated formula: C21 H13 Br2 N3
• SMILES: Brc1cccc(n1)c1cc(cc(n1)c1cccc(n1)Br)c1ccccc1
• Title of publication: 6,6''-Dibromo-4'-phenyl-2,2':6',2''-terpyridine
• Authors of publication: Constable, E. C.; Khan, F. K.; Marquez, V. E.; Raithby, P. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 5
• Pages of publication: 932 - 934
• a: 7.366 ± 0.003 Å
• b: 12.006 ± 0.004 Å
• c: 20.601 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1821.9 ± 1.1 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P b c n
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No