Geometry & MOs
Info
ID: |
381224 |
PubChem CID: |
134971889 |
Reduced: |
O2C8H15 (1) |
Stoich.: |
A2B8C15 (1) |
Weight, g/mol: |
419.00184 |
ΔHf, kcal/mol: |
-77.37 |
Dipole, Da: |
0.71 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.752705 |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-iodo-5-methyl-11-oxo-6,6a-dihydro-5H-isoindolo[2,1-a]quinoline-10-carboxylic acid