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. Author manuscript; available in PMC: 2023 Jul 21.
Published in final edited form as: Results Chem. 2023 Jan 5;5:100770. doi: 10.1016/j.rechem.2023.100770

Table 1.

The calculated molar extinction coefficients and fluorescence quantum yields of the fluorinated benzenes in acetonitrile.

Compound Ground State Symmetry ε (M−1cm−1) ΦF Excitation wavelength (nm ± 2.5 nm) Emission λmax (nm ± 2.5 nm)
FB C2v 254 nm –
571 ± 41
260 nm –
757 ± 51
266 nm –
600 ± 38
0.043 ± 0.002 260 283
12DFB C2v 255 nm –
736 ± 9
260 nm –
871 ± 13
265 nm –
676 ± 10
0.038 ± 0.002 260 286
13DFB C2v 259 nm –
780 ± 14
265 nm –
632 ± 14
0.025 ± 0.001 259 282
14DFB D2h 266 nm –
2149 ± 71
272 nm –
1742 ± 66
0.102 ± 0.006 266 288
123TFB C2v 251 nm –
160 ± 15
0.0042 ± 0.0003 251 345
124TFB Cs 264 nm –
1442 ± 90
269 nm –
1106 ± 69
0.135 ± 0.008 264 293
135TFB D3h 252 nm –
137 ± 9
0.0033 ± 0.0005 252 309
1234TFB C2v 260 nm –
1338 ± 51
0.050 ± 0.003 259 367
1235TFB C2v 259 nm –
642 ± 26
0.0058 ± 0.0004 259 306
1245TFB D2h 263 nm –
1724 ± 98
0.080 ± 0.005 263 309
PFB C2v 260 nm –
651 ± 5
0.041 ± 0.002 259 305
389
FB D6h 231 nm –
663 ± 2
0.078 ± 0.005 231 365