Information card for entry 7133290

Structure parameters

• Formula: C41 H59 B N4
• Calculated formula: C41 H59 B N4
• Title of publication: Transition-metal-like coordination chemistry of dicoordinate borylenes with organic azides.
• Authors of publication: Witte, Robert; Kar, Sourav; Radacki, Krzysztof; Härterich, Marcel; Rang, Maximilian; Michel, Maximilian; Mihm, Cornelius; Czernetzki, Corinna; Brückner, Tobias; Beck, Eva; Lutz, Sarah; Dewhurst, Rian D.; Braunschweig, Holger
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 65
• Pages of publication: 8629 - 8632
• a: 9.959 ± 0.002 Å
• b: 10.779 ± 0.004 Å
• c: 18.206 ± 0.006 Å
• α: 81.921 ± 0.018°
• β: 74.267 ± 0.017°
• γ: 88.188 ± 0.015°
• Cell volume: 1862.4 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0715
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.1126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No