Geometry & MOs

Info

ID:	435698
PubChem CID:	135192187
Reduced:	OSN2F7H17C20 (1)
Stoich.:	ABC2D7E17F20 (1)
Weight, g/mol:	374.146427
ΔH_f, kcal/mol:	-342.96
Dipole, Da:	3.43
IP(EA), eV:	-8.3(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-4-methylphenyl)-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)methanesulfinamide

Drug info:

PubChemData

Smile

CCCN1C(=O)CCC2=C1C=CC(=C2)NSCC3=C(C(=C(C(=C3F)F)C(F)(F)F)F)F

DOS

IR

Vibrations