Information card for entry 7709011

Structure parameters

• Formula: C46 H49 B F10 N3
• Calculated formula: C43 H42 B F10 N3
• Title of publication: Formation of cyclic (boryl)iminomethane derivatives by insertion of isocyanides into the boron-carbon bond
• Authors of publication: Zhou, Haiyu; Wang, Jingjing; Meng, Yuxuan; Liu, Fei; Wang, Tongdao
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 16.808 ± 0.003 Å
• b: 16.731 ± 0.003 Å
• c: 31.076 ± 0.006 Å
• α: 90°
• β: 90.186 ± 0.004°
• γ: 90°
• Cell volume: 8739 ± 3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.2214
• Residual factor for significantly intense reflections: 0.085
• Weighted residual factors for significantly intense reflections: 0.1748
• Weighted residual factors for all reflections included in the refinement: 0.2077
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No