Geometry & MOs

Info

ID:	440291
PubChem CID:	135230238
Reduced:	SO2N7C15H17 (1)
Stoich.:	AB2C7D15E17 (1)
Weight, g/mol:	448.99196
ΔH_f, kcal/mol:	62.5
Dipole, Da:	3.58
IP(EA), eV:	-9.29(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-iodo-1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

Drug info:

PubChemData

Smile

CN1C(=NN=N1)N2C3=CC=CC=C3N=C2SCC(=O)N4CCOCC4

DOS

IR

Vibrations