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Dispersion, solvent and metal effects in the binding of gold cations to alkynyl ligands: implications for Au(i) catalysis.

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Figure

Fig. 1Binding modes of gold to unsaturated substrates.
Table 1Metal effect on preferred coordination mode with [M2] =[Au(PPh3)]+, BP86 calculated relative potential energies (kJ mol�1)
Fig. 2X-ray structure of (a) the [5]+ cation and (b) the [6]+ cation. ADPs areshown at the 50% probability level, hydrogen atoms are omitted for clarity.

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