Geometry & MOs

Info

ID:	22243
PubChem CID:	596385
Reduced:	SN2O2H10C11 (1)
Stoich.:	AB2C2D10E11 (1)
Weight, g/mol:	234.046299
ΔH_f, kcal/mol:	-11.32
Dipole, Da:	3.99
IP(EA), eV:	-8.82(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N

DOS

IR

Vibrations