Geometry & MOs

Info

ID:	288729
PubChem CID:	104324560
Reduced:	ClN2O2H11C16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	279.053158
ΔH_f, kcal/mol:	24.45
Dipole, Da:	1.72
IP(EA), eV:	-8.82(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-cyano-1-benzofuran-3-yl)oxy]benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(O2)C#N)OCC3=C(C=CC(=C3)Cl)N

DOS

IR

Vibrations