Information card for entry 7714364

Structure parameters

• Formula: C79 H124 B2 Ge2 Li2 N8
• Calculated formula: C79 H124 B2 Ge2 Li2 N8
• Title of publication: A planar per-borylated digermene
• Authors of publication: Zheng, Xiongfei; Crumpton, Agamemnon; Ellwanger, Mathias; Aldridge, Simon
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 21.8726 ± 0.0008 Å
• b: 16.5014 ± 0.0003 Å
• c: 25.3097 ± 0.0007 Å
• α: 90°
• β: 114.994 ± 0.004°
• γ: 90°
• Cell volume: 8279.5 ± 0.5 ų
• Cell temperature: 150 ± 0.2 K
• Ambient diffraction temperature: 150 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1114
• Weighted residual factors for all reflections included in the refinement: 0.1248
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No