Information card for entry 2014606

Structure parameters

• Chemical name: Diethyl [(Z)-1-iodo-2-phenyl-1-hexenyl]phosphonate
• Formula: C16 H24 I O3 P
• Calculated formula: C16 H24 I O3 P
• Title of publication: Diethyl [(<i>Z</i>)-1-iodo-2-phenyl-1-hexenyl]phosphonate
• Authors of publication: Mbianda, Xavier Y.; Fernandes, Manuel A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 3
• Pages of publication: o168 - o170
• a: 11.7324 ± 0.0018 Å
• b: 12.3985 ± 0.0019 Å
• c: 13.228 ± 0.002 Å
• α: 90°
• β: 101.817 ± 0.003°
• γ: 90°
• Cell volume: 1883.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0405
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes