Information card for entry 2023535

Structure parameters

• Chemical name: Bis(4-methylpiperidinium) tetrabromidoaurate(III) bromide
• Formula: C12 H28 Au Cl5 N2
• Calculated formula: C12 H28 Au Cl5 N2
• Title of publication: Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
• Authors of publication: Döring, Cindy; Jones, Peter G.
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 7
• a: 11.9196 ± 0.0004 Å
• b: 8.5545 ± 0.0003 Å
• c: 19.9052 ± 0.0007 Å
• α: 90°
• β: 102.955 ± 0.004°
• γ: 90°
• Cell volume: 1978 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0418
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections included in the refinement: 0.0513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No