Information card for entry 1567108

Structure parameters

• Formula: C42 H36 Ag13 F18 N6 O18 S6
• Calculated formula: C42 H36 Ag13 F18 N6 O18 S6
• Title of publication: Pyridine dicarbanion-bonded Ag₁₃ organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction.
• Authors of publication: Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang
• Journal of publication: Chemical science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 27
• Pages of publication: 8095 - 8103
• a: 14.0332 ± 0.0006 Å
• b: 15.3545 ± 0.0007 Å
• c: 22.418 ± 0.0009 Å
• α: 82.805 ± 0.004°
• β: 84.35 ± 0.003°
• γ: 88.156 ± 0.004°
• Cell volume: 4768.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1665
• Residual factor for significantly intense reflections: 0.1234
• Weighted residual factors for significantly intense reflections: 0.3387
• Weighted residual factors for all reflections included in the refinement: 0.3901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.195
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No