Information card for entry 7711512

Structure parameters

• Formula: C32 H29 Au2 Br2 Cl2 N P2
• Calculated formula: C32 H29 Au2 Br2 Cl2 N P2
• Title of publication: Gold(I) Complexes Bearing a PNP-Type Pincer Ligand: Photophysi-cal Properties and Catalytic Investigations
• Authors of publication: Casciotti, Martina; Romo, Guillermo; Alvarez, Maria; Molina, Francisco; Muñoz-Molina, José M; Belderrain, Tomás R. R.; Rodriguez, Laura
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 15.7361 ± 0.0004 Å
• b: 12.8876 ± 0.0003 Å
• c: 16.5348 ± 0.0004 Å
• α: 90°
• β: 90.411 ± 0.001°
• γ: 90°
• Cell volume: 3353.18 ± 0.14 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• 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: 0.0382
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0732
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No