Information card for entry 7102068

Structure parameters

• Formula: C42 H36 Ga10 N6 S16
• Calculated formula: C41.9996 H36 Ga10 N6.0004 S16
• Title of publication: [Ga10S16(NC7H9)(4)](2-): a hybrid supertetrahedral nanocluster.
• Authors of publication: Vaqueiro, Paz; Romero, M Lucia
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 31
• Pages of publication: 3282 - 3284
• a: 15.4885 ± 0.001 Å
• b: 26.9605 ± 0.0017 Å
• c: 35.32 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14748.9 ± 1.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.1251
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for all reflections: 0.0832
• Weighted residual factors for significantly intense reflections: 0.0535
• Weighted residual factors for all reflections included in the refinement: 0.0535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0385
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No