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. Author manuscript; available in PMC: 2017 Aug 2.
Published in final edited form as: Dalton Trans. 2016 Aug 2;45(31):12539–12547. doi: 10.1039/c6dt02177h

Table 1.

Optical and electrochemical properties.

Dye λmax/nm ε/M-1 cm-1 E0-0/eVa ERed/Vb ELUMO/V vs. NHEc ELUMO/eVd EHOMO/V vs. NHEe EHOMO/eVf
[Ru]1 602 12 500 1.58 – 0.99 – 0.46 – 4.11 + 1.12 – 5.69
340 20 100
[Ru]2 598 11 500 1.53 – 0.89 – 0.36 – 4.21 + 1.17 – 5.74
350 41 000

Absorption spectra and cyclic voltammograms recorded in CH2Cl2.

a

0-0 transition energy estimated from the onset of the absorption spectra.

b

Reduction potential in V vs. Fc+/Fc.

c

Estimated LUMO level in V vs. NHE, obtained from the reduction potential considering E0(Fc+/Fc) = + 0.53 vs. NHE.[15,25]

d

Estimated LUMO energy in eV, considering E0(Fc+/Fc) = – 5.1 eV.[26]

e

Estimated HOMO level in V vs. NHE, obtained from ELUMO+E0-0.

f

Estimated HOMO energy in eV, obtained from ELUMO–E0-0.