Geometry & MOs
Info
ID: |
320214 |
PubChem CID: |
126658732 |
Reduced: |
NO2C18H25 (1) |
Stoich.: |
AB2C18D25 (1) |
Weight, g/mol: |
849.365902 |
ΔHf, kcal/mol: |
-92.11 |
Dipole, Da: |
3.52 |
IP(EA), eV: |
-9.13(0.24) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-O-[2-[(E)-[1,3-benzothiazol-2-yl(dec-7-ynyl)hydrazinylidene]methyl]-4-formyloxyphenyl] 1-O-[4-(6-prop-2-enoyloxyhexoxy)phenyl] cyclohexane-1,4-dicarboxylate