Geometry & MOs

Info

ID:	268046
PubChem CID:	103597557
Reduced:	S2N3H13C17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	372.09662
ΔH_f, kcal/mol:	117.26
Dipole, Da:	4.65
IP(EA), eV:	-8.82(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dimethoxyphenyl)-2-(2-propan-2-ylsulfanylpyridin-4-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

CCSC1=NC=CC(=C1)C2=NC(=CS2)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations