Information card for entry 4127834

Structure parameters

• Formula: C102 H238 Ag33 O34 P17 Pt2 S34
• Calculated formula: C102 H238 Ag33 O34 P17 Pt2 S34
• SMILES: C(CC)OP1(OCCC)=[S][Ag]2[Ag]3456[Ag]7[Ag]89%10[S]%11P(OCCC)(OCCC)=[S][Ag]%12%13[S]%14=P(OCCC)(OCCC)[S]%15[Ag]%16%17%13[Ag]([Pt]%13%18%19%20239%17[Ag]28[S](P(=[S]%12)(OCCC)OCCC)[Ag]3[S]8P(OCCC)(OCCC)=[S][Ag]9[S]3=P(OCCC)(OCCC)[S]3[Ag]%182[Ag]2%124%20[Ag]4%17[S]7=P(OCCC)(OCCC)[S]7[Ag]%18[S]%20P(OCCC)(OCCC)=[S][Ag]%21%22[S]=P(OCCC)(OCCC)[S]%23[Ag]%24%25%26[Ag]4%20[Pt]4%20%27%28%29%12%17%25[Ag]%12%17%22[S]%22=P(OCCC)(OCCC)[S]%21[Ag]%23%26[S](P(OCCC)(OCCC)=[S][Ag]%28[Ag]%212%27([S]([Ag]%19([Ag]%16%138)[Ag]5[S]=P(OCCC)(OCCC)S[Ag]%21[Ag]2%29[Ag]%20%17[S]%18P(OCCC)(OCCC)=[S][Ag]7[S]=P(OCCC)(OCCC)[S]62)P(OCCC)(OCCC)=[S]9)[Ag]3%24)[Ag]%22[S]=P(OCCC)(OCCC)S[Ag]4%12)[S]=P(OCCC)(S[Ag]%15[S]1[Ag]%10%11%14)OCCC
• Title of publication: Homoleptic Platinum/Silver Superatoms Protected by Dithiolates: Linear Assemblies of Two and Three Centered Icosahedra Isolobal to Ne₂ and I₃<sup/>.
• Authors of publication: Chiu, Tzu-Hao; Liao, Jian-Hong; Gam, Franck; Chantrenne, Isaac; Kahlal, Samia; Saillard, Jean-Yves; Liu, C. W.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 33
• Pages of publication: 12957 - 12961
• a: 32.668 ± 0.002 Å
• b: 17.4136 ± 0.0013 Å
• c: 37.113 ± 0.003 Å
• α: 90°
• β: 99.1282 ± 0.0014°
• γ: 90°
• Cell volume: 20845 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0578
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No