Information card for entry 4063423

Structure parameters

• Formula: C27 H20 F3 O P Te
• Calculated formula: C27 H20 F3 O P Te
• SMILES: [Te](/C(=C/P(=O)(c1ccccc1)c1ccccc1)c1ccc(C(F)(F)F)cc1)c1ccccc1
• Title of publication: Highly Selective Phosphinotelluration of Terminal Alkynes Using a (Ph2P)2‒(PhTe)2Mixed System upon Visible Light Irradiation: Straightforward Access to 1-Phosphino-2-telluro-alkenes
• Authors of publication: Kawaguchi, Shin-ichi; Ohe, Takashi; Shirai, Takamune; Nomoto, Akihiro; Sonoda, Motohiro; Ogawa, Akiya
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 2
• Pages of publication: 312 - 316
• a: 13.39 ± 0.007 Å
• b: 6.393 ± 0.003 Å
• c: 29.221 ± 0.011 Å
• α: 90°
• β: 93.13 ± 0.02°
• γ: 90°
• Cell volume: 2498 ± 2 ų
• Cell temperature: 296.1 K
• Ambient diffraction temperature: 296.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No