Geometry & MOs

Info

ID:	335662
PubChem CID:	127254524
Reduced:	NOC7H7 (4)
Stoich.:	ABC7D7 (4)
Weight, g/mol:	401.083413
ΔH_f, kcal/mol:	-99.49
Dipole, Da:	7.71
IP(EA), eV:	-8.22(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)-N-(1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC(=O)N1CC2=C(C1=O)C(C3=CN(C4=CC=CC(=C43)N2)C)C5=CC=C(C=C5)OCCN6CCCC6=O

DOS

IR

Vibrations