Geometry & MOs

Info

ID:	56642
PubChem CID:	17487299
Reduced:	FSN3O4C17H20 (1)
Stoich.:	ABC3D4E17F20 (1)
Weight, g/mol:	284.038627
ΔH_f, kcal/mol:	-180.28
Dipole, Da:	1.72
IP(EA), eV:	-9.58(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3)F

DOS

IR

Vibrations