Geometry & MOs

Info

ID:	334895
PubChem CID:	127253701
Reduced:	N3O8C35H43 (1)
Stoich.:	A3B8C35D43 (1)
Weight, g/mol:	322.095357
ΔH_f, kcal/mol:	-257.64
Dipole, Da:	9.21
IP(EA), eV:	-8.28(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C(=O)NC1=CC=C(C=C1)OCCO)NC2=CC=C3C(=CC2=O)[C@H](CCC4=CC(=C(C(=C43)OC)OC)OC)NC(=O)C

DOS

IR

Vibrations