Geometry & MOs

Info

ID:	29924
PubChem CID:	838275
Reduced:	FN2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	328.068177
ΔH_f, kcal/mol:	-7.63
Dipole, Da:	4.98
IP(EA), eV:	-8.2(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-2-(4-fluoroanilino)-5-[(4-methoxyphenyl)methylidene]-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

C1C[C@@H]2C3=C(C1)C4=C(N3CCN2)C=CC(=C4)F

DOS

IR

Vibrations