Information card for entry 1513771

Structure parameters

• Formula: C25 H23 Au2 Cl4 N P2
• Calculated formula: C25 H23 Au2 Cl4 N P2
• SMILES: CN1[P](c2ccccc2)(c2ccccc2)[Au]([Au]([P]1(c1ccccc1)c1ccccc1)(Cl)Cl)(Cl)Cl
• Title of publication: Exceptionally fast carbon-carbon bond reductive elimination from gold(III).
• Authors of publication: Wolf, William J.; Winston, Matthew S.; Toste, F. Dean
• Journal of publication: Nature chemistry
• Year of publication: 2014
• Journal volume: 6
• Journal issue: 2
• Pages of publication: 159 - 164
• a: 8.8394 ± 0.0008 Å
• b: 16.1038 ± 0.0014 Å
• c: 22.1064 ± 0.0019 Å
• α: 90°
• β: 100.248 ± 0.004°
• γ: 90°
• Cell volume: 3096.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0652
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.0981
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No