Geometry & MOs

Info

ID:	440340
PubChem CID:	135230288
Reduced:	SN7H15C19 (1)
Stoich.:	AB7C15D19 (1)
Weight, g/mol:	357.056342
ΔH_f, kcal/mol:	193.91
Dipole, Da:	4.89
IP(EA), eV:	-9.11(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

Drug info:

PubChemData

Smile

CN1C(=NN=N1)N2C3=CC=CC=C3N=C2SCC4=NC=CC5=CC=CC=C54

DOS

IR

Vibrations