Information card for entry 7121347

Structure parameters

• Formula: C34 H25 F3 N2 O3 S
• Calculated formula: C34 H25 F3 N2 O3 S
• Title of publication: An umpolung of Lewis acidity/basicity at nitrogen by deprotonation of a cyclic (amino)(aryl)nitrenium cation.
• Authors of publication: Zhou, Jiliang; Liu, Liu Leo; Cao, Levy L.; Stephan, Douglas W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 35
• Pages of publication: 4390 - 4393
• a: 8.449 ± 0.0006 Å
• b: 17.2112 ± 0.0009 Å
• c: 19.6802 ± 0.0011 Å
• α: 90°
• β: 91.062 ± 0.003°
• γ: 90°
• Cell volume: 2861.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 149.98 K
• Number of distinct elements: 6
• 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: 0.1308
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1262
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No