Information card for entry 2227301

Structure parameters

• Chemical name: Tris(2,4-di-<i>tert</i>-butylphenyl) phosphate
• Formula: C42 H63 O4 P
• Calculated formula: C42 H63 O4 P
• Title of publication: Tris(2,4-di-<i>tert</i>-butylphenyl) phosphate
• Authors of publication: Vinuchakkaravarthy, T.; Sangeetha, C. K.; Velmurugan, D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: o2207 - o2208
• a: 15.702 ± 0.004 Å
• b: 16.262 ± 0.004 Å
• c: 16.262 ± 0.004 Å
• α: 90°
• β: 91.578 ± 0.006°
• γ: 90°
• Cell volume: 4150.9 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1157
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes