Geometry & MOs

Info

ID:	336780
PubChem CID:	127255787
Reduced:	IO2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	291.95964
ΔH_f, kcal/mol:	-65.5
Dipole, Da:	4.42
IP(EA), eV:	-9.44(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxy-2-iodophenyl)propanoic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CCC(=O)O)I

DOS

IR

Vibrations