Geometry & MOs

Info

ID:	264656
PubChem CID:	103480611
Reduced:	BrClON3H11C14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	371.92319
ΔH_f, kcal/mol:	31.54
Dipole, Da:	3.74
IP(EA), eV:	-8.3(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-3-chlorophenyl)-2-(chloromethyl)-4-fluorobenzimidazole

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1N=C(N2C3=C(C(=CC=C3)Cl)Br)N

DOS

IR

Vibrations