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Table 2.
Positions of the harbor modes in PAH species besides Rubi•+ retrieved from the PAHdb.
| UID (a) | νk | σint | Charge | Layout (b) |
|---|---|---|---|---|
| cm−1 | km mol−1 | |||
| C16H10 | ||||
| 387 | 1139 | 8 | 0 | Type I |
| 388 | 1094 | 97 | +1 | Type I |
| C20H12 | ||||
| 391 | 1048 | 0.6 | 0 | Type I |
| 392 | 1034 | 199 | +1 | Type I |
| C48H20 | ||||
| 146 | 1023 | 11 | 0 | Type I |
| 147 | 1028 | 23 | +1 | Type I |
| C20H12 | ||||
| 390 | 1048 | 100 | +1 | Type II |
| 391 | 1099 | 47 | 0 | Type II |
| 397 | 1097 | 37 | −1 | Type II |
| C20H12 | ||||
| 395 | 1125 | 3 | 0 | Type I/II |
| 396 | 1087 | 35 | +1 | Type I/II |
| 398 | 1098 | 0.3 | −1 | Type I/II |
Notes. See Sect. 4.3 for details.
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