Geometry & MOs

Info

ID:	334083
PubChem CID:	127252635
Reduced:	O8H16C27 (1)
Stoich.:	A8B16C27 (1)
Weight, g/mol:	454.189257
ΔH_f, kcal/mol:	-199.48
Dipole, Da:	6.56
IP(EA), eV:	-8.72(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[3-(N-methylanilino)propyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=C(C3=C(O2)C4=CC=CC=C4OC3=O)C5=C(C6=CC=CC=C6OC5=O)O)O

DOS

IR

Vibrations