Information card for entry 7712106

Structure parameters

• Formula: C33 H43 Au Cl N O4
• Calculated formula: C33 H43 Au Cl N O4
• Title of publication: On the mercuration, palladation, transmetalation and direct auration of a C^N^C pincer ligand.
• Authors of publication: McEllin, Alice Jane; Goult, Christopher A.; Whitwood, Adrian C.; Lynam, Jason M.; Bruce, Duncan W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 4
• Pages of publication: 872 - 876
• a: 11.08601 ± 0.00014 Å
• b: 18.3382 ± 0.0002 Å
• c: 30.5993 ± 0.0005 Å
• α: 90°
• β: 94.3823 ± 0.0014°
• γ: 90°
• Cell volume: 6202.57 ± 0.15 ų
• Cell temperature: 109.95 ± 0.1 K
• Ambient diffraction temperature: 109.95 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0427
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No