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. 2023 Apr 24;24(9):7780. doi: 10.3390/ijms24097780

Table 1.

The absorption maximum wavelengths (λAbs), the molar extinction coefficients at λAbs (ε) the fluorescence emission maxima (λEm), and the quantum yields (Φf) determined in various solvents for 1,5-diisocyanonaphthalene (DIN). The dielectric constants of the solvents (εr) are listed next to the solvent names.

Solvent (εr) Experimental Computed
λAbs (nm) ε × 10−3 (M−1cm−1) λEm
(nm)
Φf
(%)
λAbs
(nm)
λEm
(nm)
n-Hexane (1.89) 300 10.3 329, 344 13.2 290 349
Dioxane (2.25) 302 14.2 331, 346 17.7 nc nc
Toluene (2.38) 302 11.0 352 21.4 291 352
EtOAc (6.02) 300 14.9 330, 345 15.7 nc nc
THF (7.58) 300 11.6 331, 346 14.8 291 360
DCM (8.93) 302 14.6 331, 346 10.0 291 361
Pyridine (12.4) 304 9.8 337, 352 0.7 nc nc
2-Propanol (17.9) 300 13.3 330, 345 19.4 nc nc
Methanol (32.7) 300 12.0 330, 345 18.3 290 365
DMF (36.7) 302 13.3 333, 347 1.1 291 365
Acetonitrile (37.5) 300 11.4 330, 345 20.6 290 365
DMSO (46.7) 303 11.3 - 0.5 291 365
Water (80.1) 300 4.0 330, 345 - 290 366

nc: not calculated.