Information card for entry 7028889

Structure parameters

• Formula: C98 H160 Ag8 N8 S8
• Calculated formula: C98 H160 Ag8 N8 S8
• Title of publication: N-heterocyclic carbenes as effective ligands for the preparation of stabilized copper- and silver-t-butylthiolate clusters.
• Authors of publication: Najafabadi, Bahareh Khalili; Corrigan, John F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 5
• Pages of publication: 2104 - 2111
• a: 9.99 ± 0.003 Å
• b: 12.648 ± 0.004 Å
• c: 23.429 ± 0.009 Å
• α: 78.597 ± 0.013°
• β: 78.069 ± 0.009°
• γ: 80.553 ± 0.012°
• Cell volume: 2815.7 ± 1.6 ų
• Cell temperature: 111 ± 2 K
• Ambient diffraction temperature: 111 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0778
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No