Information card for entry 7120166

Structure parameters

• Formula: C41 H80 Ge5 K2 N6 Ni2 O15
• Calculated formula: C41 H80 Ge5 K2 N6 Ni2 O15
• Title of publication: [Ge5Ni2(CO)3]2-：The first functionalized cluster of closo-[Ge5]2−
• Authors of publication: Sun, Zhong-Ming; Liu, Chao; Li, Leijiao; Pan, Qing-Jiang
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 10.895 ± 0.0017 Å
• b: 13.52 ± 0.002 Å
• c: 21.603 ± 0.003 Å
• α: 95.33 ± 0.003°
• β: 96.484 ± 0.003°
• γ: 110.884 ± 0.003°
• Cell volume: 2923.5 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1042
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No