Information card for entry 4064908

Structure parameters

• Formula: C9 H12 Au2 Br6 N4
• Calculated formula: C9 H12 Au2 Br6 N4
• SMILES: C1(N(C=CN1CN1C(N(C=C1)C)=[Au](Br)(Br)Br)C)=[Au](Br)(Br)Br
• Title of publication: Dinuclear N-Heterocyclic Dicarbene Gold Complexes in I‒III and III‒III Oxidation States: Synthesis and Structural Analysis
• Authors of publication: Baron, Marco; Tubaro, Cristina; Basato, Marino; Biffis, Andrea; Natile, Marta M.; Graiff, Claudia
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 17
• Pages of publication: 4607
• a: 8.194 ± 0.003 Å
• b: 13.782 ± 0.004 Å
• c: 18.827 ± 0.006 Å
• α: 90°
• β: 82.507 ± 0.006°
• γ: 90°
• Cell volume: 2108 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1048
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1321
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No