Geometry & MOs

Info

ID:	440430
PubChem CID:	135230407
Reduced:	SN4C7H8 (2)
Stoich.:	AB4C7D8 (2)
Weight, g/mol:	338.065989
ΔH_f, kcal/mol:	170.67
Dipole, Da:	2.32
IP(EA), eV:	-8.7(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[2-(pyridin-2-ylmethylsulfanyl)benzimidazol-1-yl]-1,2-thiazole

Drug info:

PubChemData

Smile

CNC1=NC(=CS1)CSC2=NC3=CC=CC=C3N2C(=N)N(C)N=N

DOS

IR

Vibrations