Information card for entry 7714366

Structure parameters

• Formula: C64 H80 B4 Ge2 N4 O4
• Calculated formula: C64 H80 B4 Ge2 N4 O4
• 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: 11.9393 ± 0.0002 Å
• b: 22.4852 ± 0.0002 Å
• c: 36.1463 ± 0.0005 Å
• α: 99.144 ± 0.001°
• β: 94.358 ± 0.001°
• γ: 92.428 ± 0.001°
• Cell volume: 9538.1 ± 0.2 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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: 0.063
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1169
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No