Geometry & MOs

Info

ID:	249404
PubChem CID:	103089179
Reduced:	FSCl2N2O2C13H19 (1)
Stoich.:	ABC2D2E2F13G19 (1)
Weight, g/mol:	252.129634
ΔH_f, kcal/mol:	-131.68
Dipole, Da:	3.17
IP(EA), eV:	-9.52(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylanilino)-5-methylsulfanylpentanamide

Drug info:

PubChemData

Smile

CC(C)C(CCN(C)S(=O)(=O)C1=C(C(=C(C=C1)Cl)F)Cl)N

DOS

IR

Vibrations