Information card for entry 7702025

Structure parameters

• Formula: C32 H21 B F15 N
• Calculated formula: C32 H21 B F15 N
• Title of publication: B(C6F5)3 mediated arene hydrogenation/transannulation of para-methoxyanilines.
• Authors of publication: Longobardi, Lauren E.; Mahdi, Tayseer; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 16
• Pages of publication: 7114 - 7117
• a: 18.886 ± 0.004 Å
• b: 16.05 ± 0.003 Å
• c: 19.128 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5798 ± 2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1129
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.165
• Weighted residual factors for all reflections included in the refinement: 0.1912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0743
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No