Geometry & MOs

Info

ID:	35954
PubChem CID:	7980539
Reduced:	FNSO2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	346.115127
ΔH_f, kcal/mol:	-110.81
Dipole, Da:	3.73
IP(EA), eV:	-8.84(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methylphenyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)C(=O)CCC(=O)NC2=C(C=C(C=C2)F)C

DOS

IR

Vibrations