Information card for entry 7033113

Structure parameters

• Formula: C41 H20 B F15 O Te
• Calculated formula: C41 H20 B F15 O Te
• SMILES: [Te](C(=C(\c1c(F)c(F)c(F)c(F)c1F)[B]([O]=Cc1ccccc1)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)\c1ccccc1)CCc1ccccc1
• Title of publication: 1,1-Carboboration to tellurium-boron intramolecular frustrated Lewis pairs.
• Authors of publication: Tsao, Fu An; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 1
• Pages of publication: 71 - 74
• a: 10.8865 ± 0.0007 Å
• b: 20.8896 ± 0.0017 Å
• c: 16.4939 ± 0.0013 Å
• α: 90°
• β: 104.061 ± 0.003°
• γ: 90°
• Cell volume: 3638.6 ± 0.5 ų
• Cell temperature: 149 ± 2 K
• Ambient diffraction temperature: 149 ± 2 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 all reflections: 0.0349
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0518
• Weighted residual factors for all reflections included in the refinement: 0.0556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No