Information card for entry 7131127

Structure parameters

• Formula: C60 H20 B4 F40 N4 O8
• Calculated formula: C60 H20 B4 F40 N4 O8
• Title of publication: Transient hydroboration and hydroalumination of activated azo-species: avenues to NBO and NAlO-heterobicycles.
• Authors of publication: Mandal, Dipendu; Hussain, Zahid; Luo, Yong-An; Wu, Yile; Stephan, Douglas W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 6
• Pages of publication: 780 - 783
• a: 10.9606 ± 0.0004 Å
• b: 12.4225 ± 0.0005 Å
• c: 12.8685 ± 0.0005 Å
• α: 113.438 ± 0.002°
• β: 90.927 ± 0.002°
• γ: 101.042 ± 0.002°
• Cell volume: 1569.5 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0917
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No