Geometry & MOs

Info

ID:	20166
PubChem CID:	580698
Reduced:	ClNOSF3H13C16 (1)
Stoich.:	ABCDE3F13G16 (1)
Weight, g/mol:	359.035847
ΔH_f, kcal/mol:	-170.38
Dipole, Da:	2.02
IP(EA), eV:	-9.32(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenyl)methylsulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CSCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations