Information card for entry 4105513

Structure parameters

• Formula: C39 H36 Au Cl N2 S4
• Calculated formula: C39 H36 Au Cl N2 S4
• Title of publication: Electropolymerization of an N-Heterocyclic Carbene-Gold(I) Complex
• Authors of publication: Adam B. Powell; Christopher W. Bielawski; Alan H. Cowley
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 18232 - 18233
• a: 32.529 ± 0.004 Å
• b: 6.272 ± 0.0008 Å
• c: 36.401 ± 0.005 Å
• α: 90°
• β: 95.816 ± 0.012°
• γ: 90°
• Cell volume: 7388.4 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1038
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.144
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.224
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No