Geometry & MOs

Info

ID:	389054
PubChem CID:	134991003
Reduced:	NOC21H31 (1)
Stoich.:	ABC21D31 (1)
Weight, g/mol:	552.88832
ΔH_f, kcal/mol:	-10.28
Dipole, Da:	1.69
IP(EA), eV:	-8.71(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-formamido-3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoic acid

Drug info:

PubChemData

Smile

CCN(CC)CCOC(C)(C1CC2CC1C=C2)C3=CC=CC=C3

DOS

IR

Vibrations