Geometry & MOs

Info

ID:	273740
PubChem CID:	103799490
Reduced:	ClNSO3C14H20 (1)
Stoich.:	ABCD3E14F20 (1)
Weight, g/mol:	329.06009
ΔH_f, kcal/mol:	-131.27
Dipole, Da:	3.28
IP(EA), eV:	-8.93(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-hydroxy-1-methoxybutan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)CCSC1=CC=C(C=C1)Cl

DOS

IR

Vibrations