Information card for entry 1573944

Structure parameters

• Formula: C26.33333 H20.66667 Au Cl0.66667 P
• Calculated formula: C26.3333 H20.6667 Au Cl0.666667 P
• SMILES: [Au](C#Cc1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.ClCCl
• Title of publication: Electrocatalytic nitrogen reduction to ammonia by graphene-supported Au₄Cu₂ and Au₂Ag₂ nanoclusters.
• Authors of publication: Shehzad, Aamir; Yi, Qiuhao; Cui, Chaonan; Luo, Zhixun
• Journal of publication: Nanoscale
• Year of publication: 2025
• Journal volume: 17
• Journal issue: 12
• Pages of publication: 7453 - 7459
• a: 13.1746 ± 0.0008 Å
• b: 12.7141 ± 0.0008 Å
• c: 39.686 ± 0.004 Å
• α: 90°
• β: 94.67 ± 0.007°
• γ: 90°
• Cell volume: 6625.5 ± 0.9 ų
• Cell temperature: 170 ± 0.1 K
• Ambient diffraction temperature: 170 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.207
• Residual factor for significantly intense reflections: 0.156
• Weighted residual factors for significantly intense reflections: 0.3465
• Weighted residual factors for all reflections included in the refinement: 0.3686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No