Information card for entry 7035782

Structure parameters

• Formula: C16 H14 Au2 Br6 N8
• Calculated formula: C16 H14 Au2 Br6 N8
• SMILES: [Au](Br)(Br)(Br)[Br-].[Au](Br)[Br-].[nH+]1c(nccc1)c1ncccn1.[nH+]1c(nccc1)c1ncccn1
• Title of publication: Weak aurophilic interactions in a series of Au(iii) double salts.
• Authors of publication: Chernyshev, Alexander N.; Chernysheva, Maria V.; Hirva, Pipsa; Kukushkin, Vadim Yu; Haukka, Matti
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 32
• Pages of publication: 14523 - 14531
• a: 7.8158 ± 0.0003 Å
• b: 9.9916 ± 0.0004 Å
• c: 17.1423 ± 0.0007 Å
• α: 94.989 ± 0.001°
• β: 90.808 ± 0.001°
• γ: 106.459 ± 0.001°
• Cell volume: 1277.91 ± 0.09 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0406
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.0505
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No