Geometry & MOs

Info

ID:	301962
PubChem CID:	123105171
Reduced:	ClNSO2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	352.028456
ΔH_f, kcal/mol:	-51.0
Dipole, Da:	3.78
IP(EA), eV:	-8.93(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)methylsulfinyl]-N-(3-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)CS(=O)CC2=CC=CC=C2Cl

DOS

IR

Vibrations