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. 2022 Sep 26;13(41):12034–12044. doi: 10.1039/d2sc04661j

Summary of the molecular weights, thermal, optical, electrochemical, XRD and AFM parameters of polymers P1–P3.

M n a (kDa) Đ T d (°C) λmaxsolb (nm) λmaxfilmc (nm) HOMOd (eV) LUMOd (eV) (Eelg)e (eV) Egoptf (eV) Lamellar ddd,g (Å) π–π ddd,g (Å) RMS (nm)
P1 12 1.8 314 561 550 −4.85 −3.50 1.35 1.51 21.53 3.77 0.80
P2 14 2.0 324 584 592 −4.83 −3.51 1.32 1.49 23.86 4.50 1.04
P3 20 2.1 326 750 745 −4.81 −3.53 1.28 1.22 19.19 3.69 0.75
a

Determined by GPC (against polystyrene standards) in chlorobenzene at 85 °C.

b

λ max in chlorobenzene solution.

c

Spin-coated from chlorobenzene solution onto a glass surface.

d

E HOMO/ELUMO = [−(EonsetEonset (FC/FC+vs. Ag/Ag+)) − 4.8] eV, where 4.8 eV is the energy level of ferrocene below the vacuum level and the formal potential Eonset(FC/FC+vs. Ag/Ag+) is equal to 0.45 V.

e

Electrochemical bandgap: Eelg = Eox/onsetEred/onset.

f

Optical bandgap: Egopt = 1240/λedge.

g

Calculated by using Bragg's Law d = λ/(2 sin θ), where λ = 1.5406 Å. (—) Non-observable.