Information card for entry 7117782

Structure parameters

• Formula: C18 H24 Au2 N6 S4
• Calculated formula: C18 H24 Au2 N6 S4
• Title of publication: Controlling intermolecular aurophilicity in emissive dinuclear Au(I) materials and their luminescent response to ammonia vapour
• Authors of publication: Ryan J. Roberts; Debbie Le; Daniel B. Leznoff
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14299
• a: 9.6338 ± 0.0019 Å
• b: 22.019 ± 0.004 Å
• c: 11.351 ± 0.002 Å
• α: 90°
• β: 91.513 ± 0.003°
• γ: 90°
• Cell volume: 2407 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0416
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No