Optimized selected bond lengths of the studied molecules obtained by B3LYP/6-31G level in gas and chlorobenzene solvent phases
| Dye . | Gas . | Chlorobenzene . | ||
|---|---|---|---|---|
| (D-π) . | (π-A) . | (D-π) . | (π-A) . | |
| OD1 | 1.45391 | 1.48970 | 1.45301 | 1.48929 |
| OD2 | 1.45372 | 1.48861 | 1.45283 | 1.48826 |
| OD3 | 1.48347 | 1.48722 | 1.48368 | 1.48696 |
| OD4 | 1.45650 | 1.48595 | 1.45463 | 1.48591 |
| OD5 | 1.48336 | 1.48666 | 1.48340 | 1.48739 |
| OD6 | 1.45866 | 1.48433 | 1.48880 | 1.48501 |
| Dye . | Gas . | Chlorobenzene . | ||
|---|---|---|---|---|
| (D-π) . | (π-A) . | (D-π) . | (π-A) . | |
| OD1 | 1.45391 | 1.48970 | 1.45301 | 1.48929 |
| OD2 | 1.45372 | 1.48861 | 1.45283 | 1.48826 |
| OD3 | 1.48347 | 1.48722 | 1.48368 | 1.48696 |
| OD4 | 1.45650 | 1.48595 | 1.45463 | 1.48591 |
| OD5 | 1.48336 | 1.48666 | 1.48340 | 1.48739 |
| OD6 | 1.45866 | 1.48433 | 1.48880 | 1.48501 |
Optimized selected bond lengths of the studied molecules obtained by B3LYP/6-31G level in gas and chlorobenzene solvent phases
| Dye . | Gas . | Chlorobenzene . | ||
|---|---|---|---|---|
| (D-π) . | (π-A) . | (D-π) . | (π-A) . | |
| OD1 | 1.45391 | 1.48970 | 1.45301 | 1.48929 |
| OD2 | 1.45372 | 1.48861 | 1.45283 | 1.48826 |
| OD3 | 1.48347 | 1.48722 | 1.48368 | 1.48696 |
| OD4 | 1.45650 | 1.48595 | 1.45463 | 1.48591 |
| OD5 | 1.48336 | 1.48666 | 1.48340 | 1.48739 |
| OD6 | 1.45866 | 1.48433 | 1.48880 | 1.48501 |
| Dye . | Gas . | Chlorobenzene . | ||
|---|---|---|---|---|
| (D-π) . | (π-A) . | (D-π) . | (π-A) . | |
| OD1 | 1.45391 | 1.48970 | 1.45301 | 1.48929 |
| OD2 | 1.45372 | 1.48861 | 1.45283 | 1.48826 |
| OD3 | 1.48347 | 1.48722 | 1.48368 | 1.48696 |
| OD4 | 1.45650 | 1.48595 | 1.45463 | 1.48591 |
| OD5 | 1.48336 | 1.48666 | 1.48340 | 1.48739 |
| OD6 | 1.45866 | 1.48433 | 1.48880 | 1.48501 |
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