Information card for entry 7116586

Structure parameters

• Formula: C63 H124 As6 Ge8 K3 N8 Nb O18
• Calculated formula: C63 H124 As6 Ge8 K3 N8 Nb O18
• Title of publication: [V@Ge8As4]^3-^ and [Nb@Ge8As6]^3-^: encapsulation of electron-poor transition metal atoms
• Authors of publication: Stefan Mitzinger; Lies Broeckaert; Werner Massa; Florian Weigend; Stefanie Dehnen
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 3866
• a: 16.1475 ± 0.0007 Å
• b: 16.7769 ± 0.0006 Å
• c: 18.0373 ± 0.0008 Å
• α: 89.184 ± 0.003°
• β: 80.452 ± 0.003°
• γ: 79.42 ± 0.003°
• Cell volume: 4736.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0952
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0628
• Goodness-of-fit parameter for all reflections included in the refinement: 0.633
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No