Geometry & MOs
Info
ID: |
124984 |
PubChem CID: |
50906338 |
Reduced: |
PSO5C11H17 (1) |
Stoich.: |
ABC5D11E17 (1) |
Weight, g/mol: |
686.163556 |
ΔHf, kcal/mol: |
-257.71 |
Dipole, Da: |
1.78 |
IP(EA), eV: |
-9.09(-0.17) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl] (2S,3S)-2-(3,4-dihydroxyphenyl)-4-[(E)-3-[(Z)-2-(3,4-dihydroxyphenyl)ethenoxy]-3-oxoprop-1-enyl]-7-hydroxy-2,3-dihydro-1-benzofuran-3-carboxylate