Information card for entry 7133297

Structure parameters

• Formula: C240 H152 Au28 Cl48 Cu12 P4 S24
• Calculated formula: C240 H152 Au28 Cl48 Cu12 P4 S24
• Title of publication: Nitrate electroreduction to ammonia catalysed by atomically precise Au₂₈Cu₁₂ clusters.
• Authors of publication: Tang, Shisi; Song, Tongxin; Cai, Xiao; Ding, Weiping; Zhu, Yan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 60
• Pages of publication: 7785 - 7788
• a: 22.0728 ± 0.0013 Å
• b: 27.5087 ± 0.0014 Å
• c: 27.5493 ± 0.0015 Å
• α: 86.596 ± 0.002°
• β: 78.05 ± 0.002°
• γ: 88.55 ± 0.002°
• Cell volume: 16334.9 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1293
• Residual factor for significantly intense reflections: 0.0907
• Weighted residual factors for significantly intense reflections: 0.22
• Weighted residual factors for all reflections included in the refinement: 0.2435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.212
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No