Information card for entry 7005469

Structure parameters

• Formula: C60 H60 Ag2 N8 O2 P2 S2
• Calculated formula: C60 H60 Ag2 N8 O2 P2 S2
• SMILES: c1cccc2C(C)=[N]3[Ag]456([S](C(=N[N]5=C(c5cccc[n]45)C)N4CCOCC4)[Ag]([P](c4ccccc4)(c4ccccc4)c4ccccc4)([P](c4ccccc4)(c4ccccc4)c4ccccc4)[S]6C(=N3)N3CCOCC3)[n]12
• Title of publication: Synthesis, reaction and structure of a highly light-stable silver(I) cluster with an Ag4S4N4 core having a tridentate 4N-morpholyl 2-acetylpyridine thiosemicarbazone ligand: use of water-soluble silver(I) carboxylates as a silver(I) source.
• Authors of publication: Onodera, Kuniaki; Kasuga, Noriko Chikaraishi; Takashima, Tomomi; Hara, Akihiro; Amano, Akifumi; Murakami, Hideyuki; Nomiya, Kenji
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 33
• Pages of publication: 3646 - 3652
• a: 13.348 ± 0.002 Å
• b: 14.701 ± 0.003 Å
• c: 15.139 ± 0.003 Å
• α: 105.026 ± 0.002°
• β: 102.176 ± 0.002°
• γ: 100.29 ± 0.002°
• Cell volume: 2717.6 ± 0.9 ų
• Cell temperature: 113 K
• Ambient diffraction temperature: 113 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: 0.0586
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.1099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No