Geometry & MOs

Info

ID:	138892
PubChem CID:	52440958
Reduced:	NO2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	329.056015
ΔH_f, kcal/mol:	-120.49
Dipole, Da:	7.12
IP(EA), eV:	-8.54(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(5E)-5-[(2,4-difluorophenyl)methylidene]-2-(3-methylphenyl)imino-1,3-thiazol-4-olate

Drug info:

PubChemData

Smile

CCCCOC1=C(C=CC(=C1)/C=C(/C#N)\C(=O)NCCCOCC)OC

DOS

IR

Vibrations