Geometry & MOs

Info

ID:	29968
PubChem CID:	838619
Reduced:	ClS2N3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	332.038627
ΔH_f, kcal/mol:	55.92
Dipole, Da:	3.84
IP(EA), eV:	-8.59(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-chlorophenyl)-3,5-dimethyl-1,3-thiazol-2-ylidene]furan-2-carboxamide

Drug info:

PubChemData

Smile

CN1C(=NNC1=S)CSCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations