Information card for entry 4119026

Structure parameters

• Common name: Au24(PPh3)10(SR)5ClBr
• Formula: C220 H185 Au24 Br1.34 Cl0.67 P10 S5
• Calculated formula: C220 H185 Au24 Br1.357 Cl0.643 P10 S5
• Title of publication: Total Structure and Optical Properties of a Phosphine/Thiolate-Protected Au24 Nanocluster
• Authors of publication: Anindita Das; Tao Li; Katsuyuki Nobusada; Qiong Zeng; Nathaniel L. Rosi; Rongchao Jin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 20286 - 20289
• a: 20.3811 ± 0.0006 Å
• b: 26.9813 ± 0.0009 Å
• c: 27.5389 ± 0.0009 Å
• α: 106.895 ± 0.002°
• β: 91.108 ± 0.002°
• γ: 96.509 ± 0.002°
• Cell volume: 14375.1 ± 0.8 ų
• Cell temperature: 202 ± 2 K
• Ambient diffraction temperature: 202 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.156
• Weighted residual factors for all reflections included in the refinement: 0.1861
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No