Information card for entry 4314033

Structure parameters

• Formula: C52 H60 Au2 O4 P4 S4
• Calculated formula: C52 H60 Au2 O4 P4 S4
• SMILES: C(C[P]([Au]S[P@](c1ccc(OC)cc1)(OC1CCCC1)=S)(c1ccccc1)c1ccccc1)CC[P]([Au]S[P@@](c1ccc(OC)cc1)(OC1CCCC1)=S)(c1ccccc1)c1ccccc1
• Title of publication: Syntheses and Structures of Dinuclear Gold(I) Dithiophosphonate Complexes and the Reaction of the Dithiophosphonate Complexes with Phosphines: Diverse Coordination Types
• Authors of publication: Angelo Maspero; Ibrahim Kani; Ahmed A. Mohamed; Mohammad A. Omary; Richard J. Staples; John P. Fackler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5311 - 5319
• a: 13.2048 ± 0.0003 Å
• b: 8.6076 ± 0.0001 Å
• c: 23.9576 ± 0.0004 Å
• α: 90°
• β: 97.684 ± 0.001°
• γ: 90°
• Cell volume: 2698.61 ± 0.08 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• 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: 0.051
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No