Geometry & MOs

Info

ID:	202116
PubChem CID:	79631415
Reduced:	BrFN4H6C10 (1)
Stoich.:	ABC4D6E10 (1)
Weight, g/mol:	334.0117
ΔH_f, kcal/mol:	87.52
Dipole, Da:	10.67
IP(EA), eV:	-8.51(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-(4-ethoxyphenyl)-6-fluoro-1H-benzimidazole

Drug info:

PubChemData

Smile

C\1=CNN/C1=C\2/N=C3C=C(C(=CC3=N2)Br)F

DOS

IR

Vibrations