Geometry & MOs

Info

ID:	440338
PubChem CID:	135230285
Reduced:	OSN7H15C16 (1)
Stoich.:	ABC7D15E16 (1)
Weight, g/mol:	357.056342
ΔH_f, kcal/mol:	138.26
Dipole, Da:	6.48
IP(EA), eV:	-9.03(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloropyridin-2-yl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole

Drug info:

PubChemData

Smile

CN1C(=NN=N1)N2C3=CC=CC=C3N=C2SCC4=NC=C(C=C4)OC

DOS

IR

Vibrations