Information card for entry 7049165

Structure parameters

• Common name: 3-Et
• Chemical name: 3-Et
• Formula: C12 H17 B F3 N
• Calculated formula: C12 H17 B F3 N
• Title of publication: Alkylammoniotrifluoroborate functionalized polystyrenes: polymeric pre-catalysts for the metal-free borylation of heteroarenes.
• Authors of publication: Bouchard, Nicolas; Fontaine, Frédéric-Georges
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 15
• Pages of publication: 4846 - 4856
• a: 8.1685 ± 0.0007 Å
• b: 14.6515 ± 0.0013 Å
• c: 10.9025 ± 0.001 Å
• α: 90°
• β: 108.176 ± 0.001°
• γ: 90°
• Cell volume: 1239.71 ± 0.19 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0661
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1384
• Weighted residual factors for all reflections included in the refinement: 0.1481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No