Information card for entry 2217754

Structure parameters

• Chemical name: 2,6-di-tert-butyl-4-(methoxymethyl)phenol
• Formula: C16 H26 O2
• Calculated formula: C16 H26 O2
• Title of publication: 2,6-Di-<i>tert</i>-butyl-4-(methoxymethyl)phenol
• Authors of publication: Zeng, Tao; Sun, Ju-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: o588
• a: 14.24 ± 0.003 Å
• b: 18.012 ± 0.003 Å
• c: 13.677 ± 0.003 Å
• α: 90°
• β: 118.603 ± 0.003°
• γ: 90°
• Cell volume: 3079.9 ± 1.1 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 3
• 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: 0.1175
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1569
• Weighted residual factors for all reflections included in the refinement: 0.1891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes