Geometry & MOs
Info
ID: |
438861 |
PubChem CID: |
135228619 |
Reduced: |
ON3C28H39 (1) |
Stoich.: |
AB3C28D39 (1) |
Weight, g/mol: |
421.272927 |
ΔHf, kcal/mol: |
-5.1 |
Dipole, Da: |
5.55 |
IP(EA), eV: |
-8.18(-0.18) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1Z,3Z)-1-[3-tert-butyl-6-[(Z)-1-(dimethylamino)-3-iminoprop-1-enyl]-7-methyl-3,4-dihydro-2H-isoquinolin-1-ylidene]-3-ethylidenepentane-2,4-dione