Geometry & MOs

Info

ID:	8614
PubChem CID:	79565
Reduced:	O6C11H12 (1)
Stoich.:	A6B11C12 (1)
Weight, g/mol:	240.063388
ΔH_f, kcal/mol:	-227.85
Dipole, Da:	3.82
IP(EA), eV:	-9.55(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(carboxymethoxy)-4-methylphenoxy]acetic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OCC(=O)O)OCC(=O)O

DOS

IR

Vibrations