Table 1 Photophysical data of 3 F in different organic matrices by experiment and dipole moment of the ground-state organic matrices by TD-DFT calculation
Entry | λF (nm) | λP (nm) | S1 (eV) | T1 (eV) | Dipole moment of ground-state matrix (Debye) | ΔEST (eV) |
|---|---|---|---|---|---|---|
3F-PS | 413 | 531 | 3.00 | 2.34 | 0.4580 | 0.66 |
3F-PMMA | 412 | 524 | 3.01 | 2.37 | 1.6943 | 0.64 |
3F-PhB | 422 | 522 | 2.94 | 2.38 | 1.9406 | 0.56 |
3F-MeOBP | 436a | 522 | 2.84 | 2.38 | 2.8802 | 0.46 |