Information card for entry 2235275

Structure parameters

• Chemical name: 4-Chloro-2-[(2,6-diisopropylphenyl)iminomethyl]phenol
• Formula: C19 H22 Cl N O
• Calculated formula: C19 H22 Cl N O
• SMILES: c1c(/C=N/c2c(cccc2C(C)C)C(C)C)c(ccc1Cl)O
• Title of publication: 4-Chloro-2-[(2,6-diisopropylphenyl)iminomethyl]phenol
• Authors of publication: Balamurugan, P.; Kanmani Raja, K.; Easwaramoorthy, D.; Chakkaravarthi, G.; Rajagopal, G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: o1721
• a: 11.276 ± 0.002 Å
• b: 11.776 ± 0.002 Å
• c: 14.189 ± 0.003 Å
• α: 73.01 ± 0.03°
• β: 88.42 ± 0.02°
• γ: 85.57 ± 0.03°
• Cell volume: 1796.5 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0869
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1253
• Weighted residual factors for all reflections included in the refinement: 0.1528
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes