Information card for entry 4327354

Structure parameters

• Formula: C58 H64 Cu3 F6 O4 P7 S4
• Calculated formula: C58 H64 Cu3 F6 O4 P7 S4
• SMILES: [Cu]12[P](C[P]([Cu]34[P](C[P]([Cu]([S]13P(=[S]4)(OCC)OCC)[S]=P(S2)(OCC)OCC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Versatility of Dithiophosphates in the Syntheses of Copper(I) Complexes with Bis(diphenylphosphino)alkanes: Abstraction of Chloride from Dichloromethane
• Authors of publication: Ben-Jie Liaw; Tarlok S. Lobana; Ya-Wen Lin; Ju-Chun Wang; C. W. Liu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9921 - 9929
• a: 12.812 ± 0.002 Å
• b: 15.221 ± 0.003 Å
• c: 17.1 ± 0.003 Å
• α: 82.275 ± 0.003°
• β: 83.963 ± 0.003°
• γ: 89.726 ± 0.003°
• Cell volume: 3286 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0717
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1186
• Weighted residual factors for all reflections included in the refinement: 0.1372
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No