Information card for entry 2217938

Structure parameters

• Chemical name: (E)-4-tert-Butyl-2-(2,6-diisopropylphenyliminomethyl)-6-(morpholinomethyl)phenol
• Formula: C28 H40 N2 O2
• Calculated formula: C28 H40 N2 O2
• SMILES: Oc1c(/C=N/c2c(cccc2C(C)C)C(C)C)cc(cc1CN1CCOCC1)C(C)(C)C
• Title of publication: (<i>E</i>)-4-<i>tert</i>-Butyl-2-(2,6-diisopropylphenyliminomethyl)-6-(morpholinomethyl)phenol
• Authors of publication: Zhu, Zhichen; Cui, Jin; Zhang, Mingjie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 4
• Pages of publication: o743
• a: 10.086 ± 0.002 Å
• b: 20.394 ± 0.004 Å
• c: 12.75 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2622.6 ± 1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0928
• Weighted residual factors for all reflections included in the refinement: 0.0952
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes