Information card for entry 7241298

Structure parameters

• Formula: C25 H32 Au Cl N2
• Calculated formula: C25 H32 Au Cl N2
• SMILES: [Au](Cl)=C1N(C[C@@H]2N1c1c(C(C2)(C)C)cccc1C(C)C)c1c(cc(cc1C)C)C
• Title of publication: Syntheses of tetrahydroquinoline-based chiral carbene precursors and the related chiral NHC‒Au(i) complex
• Authors of publication: Zhan, Licheng; Zhang, Gengtao; Wang, Jiwei; Zhang, Jun
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 58
• Pages of publication: 35253 - 35256
• a: 12.53 ± 0.006 Å
• b: 12.767 ± 0.006 Å
• c: 15.21 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2433 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0386
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.073
• 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