Geometry & MOs
Info
ID: |
327151 |
PubChem CID: |
126689109 |
Reduced: |
FN2O2H33C34 (1) |
Stoich.: |
AB2C2D33E34 (1) |
Weight, g/mol: |
1466.59439 |
ΔHf, kcal/mol: |
-20.41 |
Dipole, Da: |
5.11 |
IP(EA), eV: |
-8.55(-0.21) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-tert-butyl-7-[4-[4-[2-tert-butyl-4,8-bis[5-(2-ethylhexyl)thiophen-2-yl]thieno[2,3-f][1]benzothiol-6-yl]-5-fluoro-2,1,3-benzothiadiazol-7-yl]-8,8-bis(3,7-dimethyloctyl)-7-oxa-3,12-dithiatricyclo[7.3.0.02,6]dodeca-1(9),2(6),4,10-tetraen-11-yl]-5-fluoro-2,1,3-benzothiadiazole