Information card for entry 2240048

Structure parameters

• Chemical name: Crystal structure of bis(4-allyl-2-methoxyphenyl) terephthalate
• Formula: C28 H26 O6
• Calculated formula: C28 H26 O6
• Title of publication: Crystal structure of bis(4-allyl-2-methoxyphenyl) terephthalate
• Authors of publication: Kang, Sung Kwon; Han, Byung Hee
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 10
• Pages of publication: o1138
• a: 7.8853 ± 0.0002 Å
• b: 9.0404 ± 0.0003 Å
• c: 9.4801 ± 0.0003 Å
• α: 70.66 ± 0.004°
• β: 73.817 ± 0.003°
• γ: 75.145 ± 0.002°
• Cell volume: 602.28 ± 0.04 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.1727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes