Geometry & MOs
Info
ID: |
438860 |
PubChem CID: |
135228618 |
Reduced: |
N2O3C29H40 (1) |
Stoich.: |
A2B3C29D40 (1) |
Weight, g/mol: |
433.309313 |
ΔHf, kcal/mol: |
-102.56 |
Dipole, Da: |
8.24 |
IP(EA), eV: |
-8.06(-0.61) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(E)-3-[(3Z)-3-[6-[(Z)-1-amino-3-propyliminoprop-1-en-2-yl]-7-ethyl-3-propan-2-yl-3,4-dihydro-2H-isoquinolin-1-ylidene]prop-1-en-2-yl]pent-3-en-2-one