Geometry & MOs

Info

ID:	318422
PubChem CID:	126651261
Reduced:	ON7C18H25 (1)
Stoich.:	AB7C18D25 (1)
Weight, g/mol:	468.248504
ΔH_f, kcal/mol:	24.62
Dipole, Da:	2.51
IP(EA), eV:	-8.35(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-N-tert-butyl-N-[2-(2-methylimidazo[4,5-c]quinolin-1-yl)ethyl]-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamic acid

Drug info:

PubChemData

Smile

CCOCC1=NC2=C(N1CCCCN=C(N)N)C3=CC=CC=C3N=C2N

DOS

IR

Vibrations