Information card for entry 7029476

Structure parameters

• Formula: C50 H42 Au2 P2 S2
• Calculated formula: C50 H42 Au2 P2 S2
• SMILES: S([Au][P](c1ccccc1)(c1ccccc1)c1ccccc1)Cc1ccc(cc1)c1ccc(CS[Au][P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
• Title of publication: Different emissive properties in dithiolate gold(i) complexes as a function of the presence of phenylene spacers.
• Authors of publication: Monzittu, Francesco M.; Fernández-Moreira, Vanesa; Lippolis, Vito; Arca, Massimiliano; Laguna, Antonio; Gimeno, M Concepción
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 16
• Pages of publication: 6212 - 6220
• a: 14.4157 ± 0.0002 Å
• b: 9.0211 ± 0.0001 Å
• c: 16.5956 ± 0.0002 Å
• α: 90°
• β: 105.805 ± 0.001°
• γ: 90°
• Cell volume: 2076.59 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0143
• Residual factor for significantly intense reflections: 0.0133
• Weighted residual factors for significantly intense reflections: 0.033
• Weighted residual factors for all reflections included in the refinement: 0.0333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No