Geometry & MOs

Info

ID:	338278
PubChem CID:	127258970
Reduced:	ClN3H4C6 (1)
Stoich.:	AB3C4D6 (1)
Weight, g/mol:	185.986591
ΔH_f, kcal/mol:	71.82
Dipole, Da:	4.47
IP(EA), eV:	-10.73(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1,1-dioxo-1,2-thiazolidin-3-one;hydrochloride

Drug info:

PubChemData

Smile

C1=CN=C(C(=N1)CCl)C#N

DOS

IR

Vibrations