Geometry & MOs

Info

ID:	438325
PubChem CID:	135228058
Reduced:	BrFN4H14C17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	307.132077
ΔH_f, kcal/mol:	50.21
Dipole, Da:	3.76
IP(EA), eV:	-8.67(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-ethylimidazo[1,2-a]pyridin-3-yl)-hydroxymethyl]-2-hydroxy-3-methylbenzonitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C2=C(C=CC=N2)F)NC3=C(N=CC(=C3)Br)N

DOS

IR

Vibrations