Geometry & MOs

Info

ID:	334989
PubChem CID:	127253795
Reduced:	N2O4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	472.138284
ΔH_f, kcal/mol:	-119.1
Dipole, Da:	4.13
IP(EA), eV:	-8.35(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[[5-(5-oxopyrrolidin-2-yl)-1,2,4-oxadiazol-3-yl]methyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=C2CN(CCC2=C1)C(=O)CCCN3CC4=CC=CC=C4C3=O)OC

DOS

IR

Vibrations