Geometry & MOs

Info

ID:	267986
PubChem CID:	103593304
Reduced:	ClFIN2H13C16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	413.9796
ΔH_f, kcal/mol:	19.11
Dipole, Da:	4.89
IP(EA), eV:	-9.15(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-chloroethyl)-5-fluoro-1-(3-iodophenyl)-6-methylbenzimidazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)N=C(N2C3=CC(=CC=C3)I)CCCl

DOS

IR

Vibrations