Information card for entry 4517615

Structure parameters

• Formula: C24 H35 Au Cl P
• Calculated formula: C24 H35 Au Cl P
• SMILES: [Au](Cl)[P](c1ccccc1c1ccccc1)(C(C)(CC)CC)C(C)(CC)CC
• Title of publication: Expanding Ligand Space: Preparation, Characterization, and Synthetic Applications of Air-Stable, Odorless Di-tert-alkylphosphine Surrogates
• Authors of publication: Barber, Thomas; Argent, Stephen P.; Ball, Liam T.
• Journal of publication: ACS Catalysis
• Year of publication: 2020
• Pages of publication: 5454 - 5461
• a: 10.0134 ± 0.0002 Å
• b: 14.7285 ± 0.0003 Å
• c: 15.0955 ± 0.0003 Å
• α: 90°
• β: 92.029 ± 0.002°
• γ: 90°
• Cell volume: 2224.92 ± 0.08 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0355
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0467
• Weighted residual factors for all reflections included in the refinement: 0.0506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No