Geometry & MOs

Info

ID:	53020
PubChem CID:	14709409
Reduced:	S2O3N4C14H14 (1)
Stoich.:	A2B3C4D14E14 (1)
Weight, g/mol:	351.985546
ΔH_f, kcal/mol:	-24.86
Dipole, Da:	3.13
IP(EA), eV:	-9.34(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chlorophenyl)diazenyl]-2-[(Z)-(4-oxo-1,3-thiazolidin-2-ylidene)methyl]-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N=NC2C(=O)N=C(S2)/C=C(\N)/SCC(=O)O

DOS

IR

Vibrations