Information card for entry 7714645

Structure parameters

• Formula: C16 H9.5 B0.5 F10 N
• Calculated formula: C16 H9.5 B0.5 F10 N
• Title of publication: The impact of Lewis acid variation on reactions with di-<i>tert</i>-butyl diazo diesters.
• Authors of publication: Bedi, Vaibhav; Mandal, Dipendu; Hussain, Zahid; Chen, Shi-Ming; Wu, Yile; Qu, Zheng-Wang; Grimme, Stefan; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 2
• Pages of publication: 439 - 443
• a: 20.394 ± 0.003 Å
• b: 8.2279 ± 0.0011 Å
• c: 19.557 ± 0.003 Å
• α: 90°
• β: 95.375 ± 0.006°
• γ: 90°
• Cell volume: 3267.2 ± 0.8 ų
• Cell temperature: 150.02 K
• Ambient diffraction temperature: 150.02 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0832
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.0992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0887
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No