Geometry & MOs

Info

ID:	266431
PubChem CID:	103566153
Reduced:	NO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	253.131408
ΔH_f, kcal/mol:	-16.71
Dipole, Da:	0.69
IP(EA), eV:	-9.02(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(aminomethyl)-5-methoxyphenoxy]pentanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)CN)OCC2CC3=CC=CC=C23

DOS

IR

Vibrations