Geometry & MOs

Info

ID:	440255
PubChem CID:	135230186
Reduced:	OSN8H16C17 (1)
Stoich.:	ABC8D16E17 (1)
Weight, g/mol:	329.051736
ΔH_f, kcal/mol:	124.48
Dipole, Da:	3.08
IP(EA), eV:	-9.42(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=N1)CSC2=NC3=CC=CC=C3N2C4=NN=NN4C

DOS

IR

Vibrations