Information card for entry 7019904

Structure parameters

• Common name: 1-(2-(bis(perfluorophenyl)boryl)phenyl)-2,2,6,6- tetramethylpiperidin
• Chemical name: 1-(2-(bis(perfluorophenyl)boryl)phenyl)-2,2,6,6-tetramethylpiperidin
• Formula: C27 H22 B F10 N
• Calculated formula: C27 H22 B F10 N
• SMILES: B(c1ccccc1N1C(CCCC1(C)C)(C)C)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: Hydrogen activation by 2-boryl-N,N-dialkylanilines: a revision of Piers'ansa-aminoborane.
• Authors of publication: Chernichenko, Konstantin; Nieger, Martin; Leskelä, Markku; Repo, Timo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 30
• Pages of publication: 9029 - 9032
• a: 7.891 ± 0.0005 Å
• b: 17.3435 ± 0.0015 Å
• c: 17.8672 ± 0.0015 Å
• α: 90°
• β: 101.33 ± 0.007°
• γ: 90°
• Cell volume: 2397.6 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1153
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1015
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No