Information card for entry 1517627

Structure parameters

• Formula: C16 H16 Au2 Cl4 Cu N10
• Calculated formula: C16 H16 Au2 Cl4 Cu N10
• SMILES: [Au](Cl)(Cl)(C#N)C#[N][Cu]([n]1cc[n](cc1)[Cu]([N]#C[Au](Cl)(Cl)C#N)([N]#CC)([N]#C[Au](Cl)(Cl)C#N)([n]1ccncc1)[N]#CC)([N]#CC)([N]#C[Au](Cl)(Cl)C#N)[N]#CC.N#CC.N#CC.N#CC.N#CC
• Title of publication: Targeting [AuCl2(CN)2]- units as halophilic building blocks in coordination polymers
• Authors of publication: Jeffrey S. Ovens; Kimberley N. Truong; Daniel B. Leznoff
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 403
• Pages of publication: 127 - 135
• a: 19.2613 ± 0.0006 Å
• b: 6.8059 ± 0.0002 Å
• c: 13.9284 ± 0.0007 Å
• α: 90°
• β: 132.907 ± 0.001°
• γ: 90°
• Cell volume: 1337.38 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for all reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0274
• Weighted residual factors for all reflections included in the refinement: 0.0272
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No