Information card for entry 4135029

Structure parameters

• Formula: C43 H32 Au2 Cl2 P2
• Calculated formula: C43 H32 Au2 Cl2 P2
• Title of publication: A Smart Phosphine-Diyne Polymer Displays "Turn-on" Emission with a High Selectivity for Gold(I/III) Ions.
• Authors of publication: Mackenzie, Harvey K.; Rawe, Benjamin W.; Samedov, Kerim; Walsgrove, Henry T. G.; Uva, Azalea; Han, Zeyu; Gates, Derek P.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 29.6193 ± 0.0019 Å
• b: 11.3651 ± 0.0007 Å
• c: 12.908 ± 0.0008 Å
• α: 90°
• β: 103.804 ± 0.002°
• γ: 90°
• Cell volume: 4219.7 ± 0.5 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No