Geometry & MOs

Info

ID:	374366
PubChem CID:	131327466
Reduced:	BrFON3H7C9 (1)
Stoich.:	ABCD3E7F9 (1)
Weight, g/mol:	269.9804
ΔH_f, kcal/mol:	-34.46
Dipole, Da:	7.73
IP(EA), eV:	-9.56(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-1-ethyl-7-fluorobenzimidazole-4-carbaldehyde

Drug info:

PubChemData

Smile

CN1C=NC2=C1C(=C(C=C2C(=O)N)Br)F

DOS

IR

Vibrations