Geometry & MOs

Info

ID:	435686
PubChem CID:	135192157
Reduced:	OSN2F4C20H20 (1)
Stoich.:	ABC2D4E20F20 (1)
Weight, g/mol:	472.144376
ΔH_f, kcal/mol:	-196.67
Dipole, Da:	3.1
IP(EA), eV:	-8.27(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,4-dimethyl-2-oxo-1-propyl-3H-quinolin-6-yl)-1-(2,3,5,6-tetrafluoro-4-methylphenyl)methanesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations