Information card for entry 2232793

Structure parameters

• Common name: N-brmotertiarybutylsalicylidene-2-aminopyridine
• Chemical name: 2-Bromo-4-<i>tert</i>-butyl-6-[(pyridin-2-ylimino)methyl]phenol
• Formula: C16 H17 Br N2 O
• Calculated formula: C16 H17 Br N2 O
• SMILES: c1(c(cc(cc1Br)C(C)(C)C)/C=N/c1ccccn1)O
• Title of publication: 2-Bromo-4-<i>tert</i>-butyl-6-[(pyridin-2-ylimino)methyl]phenol
• Authors of publication: Balasubramani, V.; Vinuchakkaravarthy, T.; Gopi, Sreeraj; Narasimhan, S.; Velmurugan, D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3483
• a: 10.0241 ± 0.0011 Å
• b: 16.1355 ± 0.0016 Å
• c: 9.4308 ± 0.0013 Å
• α: 90°
• β: 92.05 ± 0.006°
• γ: 90°
• Cell volume: 1524.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0441
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0757
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes