Geometry & MOs

Info

ID:	82703
PubChem CID:	49856369
Reduced:	N2O7C24H24 (1)
Stoich.:	A2B7C24D24 (1)
Weight, g/mol:	362.126657
ΔH_f, kcal/mol:	-216.8
Dipole, Da:	1.22
IP(EA), eV:	-8.48(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,9-dimethoxy-5-prop-2-enyl-12H-isoquinolino[4,3-c]quinoline-6,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=C(N(C2=O)CC=C)C3=CC=CC=C3NC(=O)OC)C(=O)OC)OC

DOS

IR

Vibrations