Geometry & MOs

Info

ID:	301868
PubChem CID:	123098691
Reduced:	SN2F3O3H17C18 (1)
Stoich.:	AB2C3D3E17F18 (1)
Weight, g/mol:	386.166414
ΔH_f, kcal/mol:	-239.4
Dipole, Da:	2.49
IP(EA), eV:	-8.57(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-6-methylphenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfinylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)NC2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations