Information card for entry 7134239

Structure parameters

• Formula: C66 H102 Al B N P
• Calculated formula: C66 H102 Al B N P
• Title of publication: A BNAlP-heterocycle.
• Authors of publication: Wellnitz, Tim; Wüst, Leonie; Braunschweig, Holger; Hering-Junghans, Christian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 20
• Pages of publication: 4014 - 4017
• a: 12.62854 ± 0.00013 Å
• b: 16.37572 ± 0.00014 Å
• c: 16.40523 ± 0.00016 Å
• α: 64.5271 ± 0.0009°
• β: 81.4188 ± 0.0008°
• γ: 85.6856 ± 0.0008°
• Cell volume: 3028.3 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.0371
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0521
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No