Geometry & MOs

Info

ID:	296677
PubChem CID:	117588209
Reduced:	ClON2C5H10 (2)
Stoich.:	ABC2D5E10 (2)
Weight, g/mol:	360.98588
ΔH_f, kcal/mol:	-109.12
Dipole, Da:	1.25
IP(EA), eV:	-9.64(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Drug info:

PubChemData

Smile

C(CNC(=O)C(=O)NCCNCCCl)NCCCl

DOS

IR

Vibrations