Geometry & MOs

Info

ID:	301976
PubChem CID:	123106152
Reduced:	ClNSO3H20C22 (1)
Stoich.:	ABCD3E20F22 (1)
Weight, g/mol:	365.085242
ΔH_f, kcal/mol:	-49.37
Dipole, Da:	4.79
IP(EA), eV:	-8.48(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methylsulfinyl]-N-(2-ethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)CC3=CC(=CC=C3)Cl

DOS

IR

Vibrations