CAS Number 2414918-25-3
Y7 (CAS number 2414918-25-3), also known as BTP-4Cl, is the chlorinated version of Y6 (BTP-4F). It has an absorption range that extends to the near infrared (NIR) and has demonstrated a power conversion efficiency (PCE) up to 15.7% with PBDB-T-2F (PM6) as the polymer donor.
Like Y6, Y7 is a highly conjugated organic semiconductor and is composed of a fused thienothienopyrrolo-thienothienoindole (TTP-TTI) core base and 2-(5,6-dichloro-3-oxo-2,3-dihydro-1H-inden-1-ylidene)malononitrile (2ClIC) end units. Y7 has an A-DAD-A structure and is therefore electron deficient and hence suitable for use as a n-type non-fullerene electron acceptor (NFA) in OPV devices.
Compared to Y6, the chlorinated acceptor Y7 shows a redshift of about 20 nm in optical absorption and about 100 meV downshift in the LUMO level. Device film containing Y7 has a higher electroluminescence quantum efficiency (EQE = 3.47 × 10-4) than that of Y6 (1.40 × 10-4) with reduced non-radiative energy loss of ~ 24 meV. This reduced non-radiative energy loss yields a higher VOC of 0.867 V compared with that of the Y6 based device (0.834 V).
Record PCEs of 16.5% and 15.3% for OPV cells with 0.09 and 1 cm2 active areas were achieved when PBDB-T-2F (PM6) was used as the polymer donor and Y7 as the acceptor with the following device structure.
Device structure: ITO/ZnO/PM6:Y7/MoO3/Al.
Thickness (nm) | VOC (V) | JSC (mA cm-2) | FF (%) | PCE (%) |
100 ± 4 | 0.867 | 25.4 | 75.0 | 16.5 (16.1 ± 0.2) |
CAS Number | 2414918-25-3 |
Chemical Formula | C82H86Cl4N8O2S5 |
Purity | >99% (1H NMR) |
Full Name | 2,2'-((2Z,2'Z)-((12,13-bis(2-ethylhexyl)-3,9-diundecyl-12,13-dihydro-[1,2,5]thiadiazolo[3,4-e]thieno[2",3’':4’,5']thieno[2',3':4,5]pyrrolo[3,2-g]thieno[2',3':4,5]thieno[3,2-b]indole-2,10-diyl)bis(methanylylidene))bis(5,6-dichloro-3-oxo-2,3-dihydro-1H-indene-2,1-diylidene))dimalononitrile |
Molecular Weight | 1517.75 g/mol |
HOMO / LUMO | HOMO = -5.65 eV, LUMO = -3.63 eV [1] |
Form | Solid powder: Dark blue to black |
Synonyms | BTP-4Cl, Y6Cl, TTPTTI-4Cl |
Classification / Family | NFAs, n-type non-fullerene electron acceptors, Organic semiconducting materials, Low band-gap small molecule, Small molecular acceptor, Organic photovoltaics, Polymer solar cells, NF-PSCs. |
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