Information card for entry 1553446

Structure parameters

• Formula: C36 H56 Au Cl N O P S
• Calculated formula: C36 H56 Au Cl N O P S
• SMILES: [Au]([P](C12CC3CC(CC(C1)C3)C2)(C12CC3CC(CC(C1)C3)C2)c1c(cccc1)[C@@H](NS(=O)C(C)(C)C)CCC(C)C)Cl
• Title of publication: Enantioselective gold-catalyzed intermolecular [2 + 2]-cycloadditions of 3-styrylindoles with N-allenyl oxazolidinone
• Authors of publication: Hu, Haoxiang; Wang, Yidong; Qian, Deyun; Zhang, Zhan-Ming; Liu, Lu; Zhang, Junliang
• Journal of publication: Organic Chemistry Frontiers
• Year of publication: 2016
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 759
• a: 12.5457 ± 0.0006 Å
• b: 22.382 ± 0.001 Å
• c: 12.6621 ± 0.0005 Å
• α: 90°
• β: 92.052 ± 0.001°
• γ: 90°
• Cell volume: 3553.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No