Information card for entry 4116602

Structure parameters

• Formula: C24 H52 O16 P4 Pt4 S8
• Calculated formula: C24 O16 P4 Pt4 S8
• SMILES: C1(C)=[O][Pt]2345[S]=P(OCC)(OCC)S[Pt]675([O]=C(C)O[Pt]587([O]=C(C)O[Pt]48([O]=C(C)O2)([S]=P(OCC)(OCC)S3)SP(OCC)(OCC)=[S]5)SP(OCC)(OCC)=[S]6)O1
• Title of publication: Syntheses and Structures of Bridge and Chelate Isomers of Tetraplatinum(II) Cluster Complex with Diethyldithiophosphate Ion (Et2dtp) at In-Plane Sites, [Pt4(CH3COO)4(Et2dtp)4], and Their Mutual Isomerization via Cluster Core Rotation
• Authors of publication: Tadashi Yamaguchi; Haruko Saito; Taro Maki; Tasuku Ito
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1999
• Journal volume: 121
• Pages of publication: 10738 - 10742
• a: 12.794 ± 0.008 Å
• b: 24.99 ± 0.003 Å
• c: 14.927 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4772 ± 3 ų
• Cell temperature: 183.2 K
• Ambient diffraction temperature: 183.2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for all reflections included in the refinement: 0.0374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.477
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No