Information card for entry 2008765

Structure parameters

• Chemical name: 2-butyl-5-methyl-6-(1-oxopyridin-2-yl)-1-{[2'-(1H-tetrazol-5-yl)biphenyl- 4-yl]methyl}-1H-imidazo[5,4-b]pyridine methanol solvate
• Formula: C31 H32 N8 O2
• Calculated formula: C31 H32 N8 O2
• Title of publication: A non-peptide angiotensin II receptor antagonist: 2-butyl-6-methyl-5-(1-oxopyrid-2-yl)-1-{[2'-(1<i>H</i>-tetrazol-5-yl)biphenyl-4-yl]methyl}-1<i>H</i>-imidazo[5,4-<i>b</i>]pyridine methanol solvate
• Authors of publication: Heo, Yong-Seok; Yi, Kyu Yang; Yoo, Sung Eun; Shin, Whanchul
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 1345 - 1347
• a: 12.235 ± 0.004 Å
• b: 13.719 ± 0.007 Å
• c: 16.974 ± 0.007 Å
• α: 90°
• β: 92.45 ± 0.05°
• γ: 90°
• Cell volume: 2847 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.1475
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.1937
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes