Information card for entry 7035780

Structure parameters

• Formula: C8 H6 Au2 Cl4 N4
• Calculated formula: C8 H6 Au2 Cl4 N4
• SMILES: [Au]1([n]2c(c3[n]1cccn3)nccc2)(Cl)Cl.[Au](Cl)[Cl-]
• 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: 48.623 ± 0.003 Å
• b: 10.4011 ± 0.0006 Å
• c: 11.0193 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5572.8 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0225
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.033
• Weighted residual factors for all reflections included in the refinement: 0.0336
• Goodness-of-fit parameter for all reflections included in the refinement: 0.974
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No