Geometry & MOs
Info
ID: |
149060 |
PubChem CID: |
53788731 |
Reduced: |
ON2S2C8H18 (1) |
Stoich.: |
AB2C2D8E18 (1) |
Weight, g/mol: |
742.31016 |
ΔHf, kcal/mol: |
-65.61 |
Dipole, Da: |
3.18 |
IP(EA), eV: |
-8.92(-1.1) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] (2S,3S,4S,5R)-6-[[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylate