Information card for entry 4518855

Structure parameters

• Formula: C22 H15 F3 N0 O0
• Calculated formula: C22 H15 F3
• SMILES: FC(F)(F)[C@]1(c2ccc(c3ccccc3)cc2)C(=C1)c1ccccc1
• Title of publication: Fluoroalkyl N-Triftosylhydrazones as Easily Decomposable Diazo Surrogates for Asymmetric [2 + 1] Cycloaddition: Synthesis of Chiral Fluoroalkyl Cyclopropenes and Cyclopropanes
• Authors of publication: Zhang, Xinyu; Tian, Chunqi; Wang, Zhanjing; Sivaguru, Paramasivam; Nolan, Steven P.; Bi, Xihe
• Journal of publication: ACS Catalysis
• Year of publication: 2021
• Pages of publication: 8527 - 8537
• a: 6.3512 ± 0.0005 Å
• b: 15.7186 ± 0.0013 Å
• c: 17.6114 ± 0.0017 Å
• α: 95.974 ± 0.007°
• β: 99.576 ± 0.007°
• γ: 94.985 ± 0.007°
• Cell volume: 1714.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1254
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.116
• Weighted residual factors for all reflections included in the refinement: 0.1529
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No