Information card for entry 4106963

Structure parameters

• Common name: TLC127 CH2Cl2/Et2O
• Formula: C60 H72 Ag2 Au2 F22 I4 N2 O4
• Calculated formula: C60 H72 Ag2 Au2 F22 I4 N2 O4
• Title of publication: Making the Golden Connection: Reversible Mechanochemical and Vapochemical Switching of Luminescence from Bimetallic Gold-Silver Clusters Associated through Aurophilic Interactions
• Authors of publication: Tania Lasanta; M. Elena Olmos; Antonio Laguna; José M. López-de-Luzuriaga; Panče Naumov
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 16358 - 16361
• a: 26.1743 ± 0.0006 Å
• b: 19.2424 ± 0.0005 Å
• c: 29.4693 ± 0.0006 Å
• α: 90°
• β: 98.154 ± 0.001°
• γ: 90°
• Cell volume: 14692.3 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.154
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.0726
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No