Information card for entry 7705337

Structure parameters

• Formula: C20 H29 Au Br2 N8
• Calculated formula: C20 H29 Au Br2 N8
• SMILES: [Au](=C1N(CCn2c[nH+]cc2)C=CN1CC)=C1N(CCn2ccnc2)C=CN1CC.[Br-].[Br-]
• Title of publication: Synthesis, conformational analysis and antibacterial activity of Au(I)-Ag(I) and Au(I)-Hg(II) heterobimetallic N-heterocyclic carbene complexes.
• Authors of publication: Li, Zili; Mackie, Emily R. R.; Ramkissoon, Pria; Mather, Joel C.; Wiratpruk, Nuchareenat; Soares da Costa, Tatiana P.; Barnard, Peter J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 36
• Pages of publication: 12820 - 12834
• a: 10.7465 ± 0.0002 Å
• b: 11.4653 ± 0.0002 Å
• c: 12.0732 ± 0.0002 Å
• α: 65.809 ± 0.002°
• β: 85.874 ± 0.002°
• γ: 80.854 ± 0.002°
• Cell volume: 1339.64 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.035
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.093
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No