Information card for entry 2223806

Structure parameters

• Chemical name: Dimethyl (2-hydroxy-4-phenylbut-3-en-2-yl)phosphonate
• Formula: C12 H17 O4 P
• Calculated formula: C12 H17 O4 P
• Title of publication: Dimethyl (2-hydroxy-4-phenylbut-3-en-2-yl)phosphonate
• Authors of publication: Tahir, M. Nawaz; Acar, Nurcan; Yilmaz, Hamza; Tariq, Riaz H.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: o2922
• a: 17.1522 ± 0.0012 Å
• b: 8.1571 ± 0.0013 Å
• c: 19.523 ± 0.0012 Å
• α: 90°
• β: 103.771 ± 0.01°
• γ: 90°
• Cell volume: 2653 ± 0.5 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0959
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.1547
• Weighted residual factors for all reflections included in the refinement: 0.1752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes