Geometry & MOs

Info

ID:	165316
PubChem CID:	74531550
Reduced:	SN2O4H16C18 (1)
Stoich.:	AB2C4D16E18 (1)
Weight, g/mol:	354.103814
ΔH_f, kcal/mol:	-80.87
Dipole, Da:	2.8
IP(EA), eV:	-8.78(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxyanilino)-5-[(2-propoxyphenyl)methylidene]-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

CN1C(=O)C(=CC2=CC(=C(C=C2)O)OC)SC1=NC3=CC=C(C=C3)O

DOS

IR

Vibrations