Information card for entry 7020743

Structure parameters

• Formula: C21 H19 B F5 N O2 Si
• Calculated formula: C21 H19 B F5 N O2 Si
• SMILES: [Si](C(c1c(F)c(F)c(F)c(F)c1F)[B]1(Oc2c(O1)cccc2)[n]1ccccc1)(C)(C)C
• Title of publication: Bulky derivatives of boranes, boronic acids and boronate esters via reaction with diazomethanes.
• Authors of publication: Neu, Rebecca C.; Jiang, Chunfang; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 3
• Pages of publication: 726 - 736
• a: 8.3043 ± 0.0008 Å
• b: 11.1169 ± 0.001 Å
• c: 12.0808 ± 0.0011 Å
• α: 94.495 ± 0.004°
• β: 107.005 ± 0.004°
• γ: 98.763 ± 0.004°
• Cell volume: 1045.11 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0961
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.1795
• Weighted residual factors for all reflections included in the refinement: 0.1974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No