Geometry & MOs

Info

ID:	301961
PubChem CID:	123105170
Reduced:	ClNSO2C19H22 (1)
Stoich.:	ABCD2E19F22 (1)
Weight, g/mol:	335.074678
ΔH_f, kcal/mol:	-59.75
Dipole, Da:	3.29
IP(EA), eV:	-8.5(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)methylsulfinyl]-N-(2,6-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NC(=O)CS(=O)CC2=CC=CC=C2Cl

DOS

IR

Vibrations