Geometry & MOs

Info

ID:	301971
PubChem CID:	123106103
Reduced:	ClNSO2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	363.105978
ΔH_f, kcal/mol:	-48.48
Dipole, Da:	2.97
IP(EA), eV:	-8.7(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butylphenyl)-2-[(3-chlorophenyl)methylsulfinyl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)CS(=O)CC2=CC(=CC=C2)Cl

DOS

IR

Vibrations