Information card for entry 4128196

Structure parameters

• Formula: C193 H136 Au10 Cl4 F12 O6 P8
• Calculated formula: C189 H136 Au10 Cl4 F6 O2 P8
• SMILES: [Au]12345[Au]6789%10%11[Au]%12%131[Au]6([Au]1%11[Au]68([Au]87[Au]7%114%106[Au]39%12([Au]2([P](c2ccccc2)(c2ccccc2)c2c(c3c4c(ccc3[P]5(c3ccccc3)c3ccccc3)cccc4)c3c(cc2)cccc3)[C]7#[C]%11c2ccc(cc2)C(F)(F)F)[P](c2ccccc2)(c2c(c3c4c(ccc3[P]8(c3ccccc3)c3ccccc3)cccc4)c3c(cccc3)cc2)c2ccccc2)[P](c2ccccc2)(c2ccc3ccccc3c2c2c([P]1(c1ccccc1)c1ccccc1)ccc1ccccc21)c1ccccc1)[P](c1ccccc1)(c1c(c2ccccc2cc1)c1c([P]%13(c2ccccc2)c2ccccc2)ccc2ccccc12)c1ccccc1.ClCCl.ClCCl.FC(F)(F)C(=O)[O-]
• Title of publication: Chiroptical Activity Enhancement via Structural Control: The Chiral Synthesis and Reversible Interconversion of Two Intrinsically Chiral Gold Nanoclusters.
• Authors of publication: Wang, Jia-Qi; Guan, Zong-Jie; Liu, Wen-Di; Yang, Yang; Wang, Quan-Ming
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 6
• Pages of publication: 2384 - 2390
• a: 19.362 ± 0.0003 Å
• b: 19.362 ± 0.0003 Å
• c: 92.9191 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 30167.3 ± 0.8 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 170
• Hermann-Mauguin space group symbol: P 65
• Hall space group symbol: P 65
• Residual factor for all reflections: 0.1171
• Residual factor for significantly intense reflections: 0.1137
• Weighted residual factors for significantly intense reflections: 0.2581
• Weighted residual factors for all reflections included in the refinement: 0.2599
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No