Geometry & MOs

Info

ID:	288820
PubChem CID:	104326448
Reduced:	ClFON3H13C15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	397.00874
ΔH_f, kcal/mol:	-20.6
Dipole, Da:	6.04
IP(EA), eV:	-8.74(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethoxy-3-fluorophenyl)-5-iodobenzimidazol-2-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)N2C3=C(C=CC(=C3)Cl)N=C2N)F

DOS

IR

Vibrations