Information card for entry 2023087

Structure parameters

• Chemical name: Tribromido(4-methylpiperidine)gold(III)
• Formula: C6 H13 Au Br3 N
• Calculated formula: C6 H13 Au Br3 N
• Title of publication: Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)
• Authors of publication: Döring, Cindy; Jones, Peter G.
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 5
• a: 12.6471 ± 0.0005 Å
• b: 8.7247 ± 0.0003 Å
• c: 21.0262 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2320.08 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0388
• Weighted residual factors for all reflections included in the refinement: 0.0429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No