Information card for entry 2212367

Structure parameters

• Chemical name: O,O-Bis(2-tert-butylphenyl) chlorothiophosphonate
• Formula: C20 H26 Cl O2 P S
• Calculated formula: C20 H26 Cl O2 P S
• Title of publication: <i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butylphenyl) chlorothiophosphonate
• Authors of publication: Odabaşoğlu, Mustafa; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: o580 - o581
• a: 17.8761 ± 0.0016 Å
• b: 8.2053 ± 0.0005 Å
• c: 14.57 ± 0.0014 Å
• α: 90°
• β: 105.863 ± 0.007°
• γ: 90°
• Cell volume: 2055.7 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes