Information card for entry 2312115

Structure parameters

• Chemical name: Triacontakis[(4-carboxylatophenyl)sulfanido]dodecagolddotriacontasilver
• Formula: C210 H150 Ag32 Au12 O60 S30
• Calculated formula: C210 H150 Ag32 Au12 O60 S30
• Title of publication: <i>M</i>₄Au₁₂Ag₃₂(<i>p</i>-MBA)₃₀ (<i>M</i> = Na, Cs) bimetallic monolayer-protected clusters: synthesis and structure.
• Authors of publication: Conn, Brian E.; Bhattarai, Badri; Atnagulov, Aydar; Yoon, Bokwon; Landman, Uzi; Bigioni, Terry P.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2018
• Journal volume: 74
• Journal issue: Pt 7
• Pages of publication: 987 - 993
• a: 25.7341 ± 0.0003 Å
• b: 25.7341 ± 0.0003 Å
• c: 124.079 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 71162 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0464
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.1326
• Weighted residual factors for all reflections included in the refinement: 0.1393
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes