Geometry & MOs

Info

ID:	321613
PubChem CID:	126666681
Reduced:	ClOSN5H18C21 (1)
Stoich.:	ABCD5E18F21 (1)
Weight, g/mol:	308.107339
ΔH_f, kcal/mol:	87.07
Dipole, Da:	1.89
IP(EA), eV:	-9.07(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-fluoro-2-[(5-methoxypyridin-2-yl)methyl]-3H-imidazo[4,5-c]quinoline

Drug info:

PubChemData

Smile

C1COCCC1N2C(=NC3=C2C4=CC=CC=C4N=C3)CC5=CN6C=C(SC6=N5)Cl

DOS

IR

Vibrations