Geometry & MOs

Info

ID:	334770
PubChem CID:	127253445
Reduced:	O4N5H29C31 (1)
Stoich.:	A4B5C29D31 (1)
Weight, g/mol:	379.141973
ΔH_f, kcal/mol:	44.26
Dipole, Da:	4.67
IP(EA), eV:	-8.62(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CC2=C1C3=CC=CC=C3N2)C(=O)[C@@H]4CC5=C(C=CC(=C5)[N+](=O)[O-])N6[C@H]4C7CC(C6)C8=CC=CC(=O)N8C7

DOS

IR

Vibrations