Geometry & MOs
Info
ID: |
397869 |
PubChem CID: |
135030862 |
Reduced: |
ON4H5C6 (1) |
Stoich.: |
AB4C5D6 (1) |
Weight, g/mol: |
424.178693 |
ΔHf, kcal/mol: |
92.02 |
Dipole, Da: |
1.25 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.777103 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(12bR)-2,3-dimethoxy-12b-(5-methyl-1H-indol-3-yl)-5,6-dihydroisoindolo[1,2-a]isoquinolin-8-one