Geometry & MOs

Info

ID:	318460
PubChem CID:	126651436
Reduced:	ON4H8C10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	525.306353
ΔH_f, kcal/mol:	39.99
Dipole, Da:	3.15
IP(EA), eV:	-8.92(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[N'-[3-(4-amino-2-propylimidazo[4,5-c]quinolin-1-yl)propyl]-N-tert-butyl-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C(=N2)N)NNC3=O

DOS

IR

Vibrations