Geometry & MOs

Info

ID:	147437
PubChem CID:	53787093
Reduced:	N3O3H23C26 (1)
Stoich.:	A3B3C23D26 (1)
Weight, g/mol:	213.001513
ΔH_f, kcal/mol:	10.85
Dipole, Da:	5.27
IP(EA), eV:	-8.67(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chlorophenyl)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C2=CC=C(C=C2)OCC(CCC3=CN=CC=C3)N4C(=CC=C4O)O)C#N

DOS

IR

Vibrations