Information card for entry 7129700

Structure parameters

• Formula: C72 H144 Co2 Ge17 K4 N8 Ni O24
• Calculated formula: C72 H144 Co2 Ge17 K4 N8 Ni O24
• Title of publication: [Co2@(Ge17Ni)]4−: The First Edge-Sharing Double-Cage Endohedral Germanide
• Authors of publication: Xu, Hong-Lei; Qiao, Lei; Sun, Zhong-Ming
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 16.6463 ± 0.0003 Å
• b: 25.7355 ± 0.0005 Å
• c: 28.7503 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12316.7 ± 0.4 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1038
• Residual factor for significantly intense reflections: 0.0771
• Weighted residual factors for significantly intense reflections: 0.2221
• Weighted residual factors for all reflections included in the refinement: 0.2433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No