Table 1. Crystallographic, Optical, and Electrochemical Data for the Trityl Radicals Reported Here.
| R = | Θaveragea | Σanglesb | λmax (nm)c | ε (M–1 cm–1)c | E(+/•)d | E(•/−)d | ΔEe | 3σp67 |
|---|---|---|---|---|---|---|---|---|
| Me2N | 403f | 58,000f | –1.17 | [−2.14] | 1.07 | –2.49 | ||
| MeO | 36.3° | 360.0(5)° | 536 | 560 | –0.58 | [−1.84] | 1.30 | –0.81 |
| tBu | 31.0° | 360.0(5)° | 525 | 815 | [−0.40] | [−1.77] | 1.37 | –0.48 |
| Ph | 30.8° | 359.9(7)° | 565 | 1000 | [−0.30] | [−1.44] | 1.14 | –0.03 |
| Cl | 27.0° | 360.0(2)° | 536 | 380 | 0.00 | [−1.27] | 1.27 | 0.69 |
| CF3 | 32.7° | 360.0(3)° | 522 | 1240 | 0.29 | –1.10 | 1.39 | 1.62 |
| NO2 | 32.0°44 | 360(1)° | 61932 g | n/a | 2.28 |
Dihedral angle defined as the angle between the plane of a phenyl group and the plane of the central 4 carbons.
Sum of angles around central methyl carbon.
Reported at room temperature in toluene unless otherwise noted. Molar extinction coefficients are reported with an uncertainty of ±3%.
Potentials in MeCN are reported as V vs Fc/Fc+. Potentials are E1/2 = (Ep,a + Ep,c)/2 except those in square brackets that are irreversible potentials, reported as the potential at the cathodic peak current, Ep,c.
ΔE = E(+/•) – E(•/−).
Reported at room temperature in MeCN.
Reported in MeCN as a saturated solution, without a concentration listed.