Information card for entry 4088263

Structure parameters

• Chemical name: AKY-487
• Formula: C27 H18 F3 O6 P W
• Calculated formula: C27 H18 F3 O6 P W
• Title of publication: C-Trifluoromethyl-Substituted 1,2-Oxaphosphetane Complexes: Synthetic and Structural Study
• Authors of publication: Kyri, Andreas W.; Schnakenburg, Gregor; Streubel, Rainer
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 4
• Pages of publication: 563
• a: 9.6002 ± 0.001 Å
• b: 10.5444 ± 0.0011 Å
• c: 13.8429 ± 0.0014 Å
• α: 71.032 ± 0.003°
• β: 76.087 ± 0.003°
• γ: 75.469 ± 0.004°
• Cell volume: 1263.3 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0298
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0481
• Weighted residual factors for all reflections included in the refinement: 0.0511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No