Table 4. NBO Partial Charges on the Fragments and Electron Configurations of Au(I).
| complex | NBO
partial charges |
Au(I) electron configuration | |
|---|---|---|---|
| ligand | Au(I) | ||
| (2SDD–)-Au+ | –0.234 | 0.234 | 6S0.835d9.786p0.15 |
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