Information card for entry 4130265

Structure parameters

• Formula: C127 H112 Au6 B2 F8 N2 O2 P6
• Calculated formula: C127 H112 Au6 B2 F8 N2 O2 P6
• Title of publication: Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response.
• Authors of publication: He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 17
• Pages of publication: 5634 - 5643
• a: 13.547 ± 0.003 Å
• b: 14.829 ± 0.003 Å
• c: 15.76 ± 0.003 Å
• α: 111.55 ± 0.03°
• β: 93.03 ± 0.03°
• γ: 98.03 ± 0.03°
• Cell volume: 2897.1 ± 1.3 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 8
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.0965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No