Information card for entry 2005603

Structure parameters

• Chemical name: 2-[1-[(4,5-dimethyl-2-aminophenyl)imino]ethyl]phenol
• Formula: C16 H18 N2 O
• Calculated formula: C16 H18 N2 O
• SMILES: Oc1c(C(=N\c2c(N)cc(c(c2)C)C)\C)cccc1
• Title of publication: 2-{1-[(2-Amino-4,5-dimethylphenyl)imino]ethyl}phenol
• Authors of publication: Corden, J. P.; Bishop, P. R.; Errington, W.; Wallbridge, M. G. H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 11
• Pages of publication: 2777 - 2779
• a: 6.728 ± 0.002 Å
• b: 7.94 ± 0.007 Å
• c: 25.085 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1340 ± 1.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.051
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for all reflections: 0.1122
• Weighted residual factors for significantly intense reflections: 0.0831
• Goodness-of-fit parameter for all reflections: 1.058
• Goodness-of-fit parameter for significantly intense reflections: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No