Geometry & MOs

Info

ID:	318454
PubChem CID:	126651424
Reduced:	SCl2F3N4O5C43H53 (1)
Stoich.:	AB2C3D4E5F43G53 (1)
Weight, g/mol:	369.123549
ΔH_f, kcal/mol:	-365.65
Dipole, Da:	6.06
IP(EA), eV:	-8.79(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-amino-2-ethylimidazo[4,5-c]quinolin-1-yl)ethyl]guanidine;dihydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OCCC(C)(C)NC(=O)CCCCCOC1=NC2=C(C=C(C=C2)C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C(=C1)NC5CCN(CC5)S(=O)(=O)C(F)(F)F

DOS

IR

Vibrations