Geometry & MOs

Info

ID:	268043
PubChem CID:	103597535
Reduced:	N2O2S2H16C17 (1)
Stoich.:	A2B2C2D16E17 (1)
Weight, g/mol:	314.054755
ΔH_f, kcal/mol:	18.74
Dipole, Da:	1.62
IP(EA), eV:	-8.3(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxyphenyl)-2-(2-methylsulfanylpyridin-4-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=CSC(=N2)C3=CC(=NC=C3)SC)OC

DOS

IR

Vibrations