Information card for entry 7246420

Structure parameters

• Formula: C228 H168 Ag17 Au10 Cl5 F36 P10 S6
• Calculated formula: C228 H168 Ag17 Au10 Cl5 F36 P10 S6
• Title of publication: Au₁₀Ag₁₇(TPP)₁₀(SR)₆Cl₅ nanocluster: structure, transformation and the origin of its photoluminescence.
• Authors of publication: Ma, Along; Wang, Jiawei; Kong, Jie; Ren, Yonggang; Wang, Yuxuan; Ma, Xiaoshuang; Zhou, Meng; Wang, Shuxin
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 14
• Pages of publication: 9772 - 9778
• a: 25.8454 ± 0.0007 Å
• b: 30.9591 ± 0.0005 Å
• c: 33.6076 ± 0.001 Å
• α: 90°
• β: 100.869 ± 0.003°
• γ: 90°
• Cell volume: 26408.7 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2127
• Residual factor for significantly intense reflections: 0.124
• Weighted residual factors for significantly intense reflections: 0.3274
• Weighted residual factors for all reflections included in the refinement: 0.3722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No