Geometry & MOs

Info

ID:	440434
PubChem CID:	135230411
Reduced:	S2N7C14H15 (1)
Stoich.:	A2B7C14D15 (1)
Weight, g/mol:	359.076471
ΔH_f, kcal/mol:	162.69
Dipole, Da:	1.58
IP(EA), eV:	-8.72(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-difluoro-1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CSC2=NC3=CC=CC=C3N2C(=N)N(C)N=N

DOS

IR

Vibrations