Geometry & MOs

Info

ID:	342178
PubChem CID:	127264891
Reduced:	SO2F3N3C12H14 (1)
Stoich.:	AB2C3D3E12F14 (1)
Weight, g/mol:	260.132491
ΔH_f, kcal/mol:	-195.41
Dipole, Da:	2.53
IP(EA), eV:	-10.21(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[(4-fluoro-3-methylphenyl)methylamino]ethyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

C1=CN=C(C=C1C(F)(F)F)CCNS(=O)(=O)CCCC#N

DOS

IR

Vibrations