Information card for entry 1546258

Structure parameters

• Formula: C199 H154 Ag19 Cl10 F18 P6 Sb3
• Calculated formula: C199 H154 Ag19 Cl10 F18 P6 Sb3
• SMILES: [Ag]12345[Ag]6789%10[Ag]%11%12%131[Ag]126([C]2([Ag]6[Ag]%14%15[Ag]%16%17%18[Ag]%19([Ag]%20%21[Ag]%22%23[P](C[P]([Ag]([C]%12([Ag]%12[Ag]%24%25[Ag]2([P](C[P]([Ag]2[C]%24([Ag]%24%263([Ag]34([Ag]5%24([C]%20%23#Cc4ccccc4)([C]%17%19#Cc4ccccc4)[C]%263#Cc3ccccc3)([C]%14%18#Cc3ccccc3)[C]62#Cc2ccccc2)[C]%22%12#Cc2ccccc2)#Cc2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)[C]%11%25#Cc2ccccc2)#Cc2ccccc2)[C]%10%21#Cc2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)[C]8([Ag]([P](C[P]%16(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)[C]1%15#Cc1ccccc1)#[C]9c1ccccc1)#Cc1ccccc1)[C]7%13#Cc1ccccc1.[Sb](F)(F)(F)(F)(F)[F-].[Sb](F)(F)([F-])(F)(F)F.[Sb](F)(F)(F)(F)([F-])F.Cc1ccccc1.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: Alkynyl-protected silver nanoclusters featuring an anticuboctahedral kernel
• Authors of publication: Yuan, Shang-Fu; Li, Pei; Tang, Qing; Wan, Xian-Kai; Nan, Zi-Ang; Jiang, De-en; Wang, Quan-Ming
• Journal of publication: Nanoscale
• Year of publication: 2017
• a: 17.6377 ± 0.0002 Å
• b: 25.6594 ± 0.0002 Å
• c: 43.3649 ± 0.0005 Å
• α: 90°
• β: 90.376 ± 0.001°
• γ: 90°
• Cell volume: 19625.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1029
• Residual factor for significantly intense reflections: 0.0848
• Weighted residual factors for significantly intense reflections: 0.2178
• Weighted residual factors for all reflections included in the refinement: 0.2337
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No