Geometry & MOs

Info

ID:	301863
PubChem CID:	123098456
Reduced:	ClSN2O3C16H23 (1)
Stoich.:	ABC2D3E16F23 (1)
Weight, g/mol:	466.132921
ΔH_f, kcal/mol:	-125.36
Dipole, Da:	5.42
IP(EA), eV:	-8.9(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-chloroanilino)-2-oxoethyl]sulfinyl-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)CS(=O)CC(=O)NC1=CC=C(C=C1)Cl

DOS

IR

Vibrations