Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
The comparable calculated absorbance λmax with experimental values for the complex 1.
| Theoretical (nm) | Experimental (nm) | Composition | CI | Electronic Transition | Energy (eV) | f |
|---|---|---|---|---|---|---|
| 320 | 323 | HOMO→LUMO HOMO-1→LUMO |
0.0259 0.3149 |
S0→S5 | 4.1652 | 0.1426 |
| 399 | 397 | HOMO-1→LUMO+1 HOMO→LUMO+2 |
0.2017 0.8161 |
S0→S3 | 3.8063 | 0.0719 |
