Table 4. Computed Nature, Excitation Energies (ΔE, in eV), Oscillator Strengths (f), and Electric Dipole Moments (μ, in D) for the Lowest Electronic States in Tyrosine.
| state | nature | ΔECASPT2 | f | μ |
|---|---|---|---|---|
| S0 | 85.6%... | ... | ... | 3.28 |
| S1 | 75.4% πr πr* | 4.49(4.40)27 | 0.0056 | 3.27 |
| S2 | 81.0% nCO πCO* | 5.54 | 0.0019 | 2.18 |
| S3 | 65.5% πr πr* | 5.67 | 0.006 | 4.01 |
| S4 | 79.1% πr πr* | 5.98 | 0.759 | 3.36 |