Geometry & MOs

Info

ID:	58911
PubChem CID:	24715632
Reduced:	SN2O2C14H20 (1)
Stoich.:	AB2C2D14E20 (1)
Weight, g/mol:	285.022642
ΔH_f, kcal/mol:	-64.44
Dipole, Da:	1.48
IP(EA), eV:	-8.88(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanoic acid

Drug info:

PubChemData

Smile

CCNCCN1C(SCC1=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations