Geometry & MOs

Info

ID:	8631
PubChem CID:	79733
Reduced:	NO2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	230.126657
ΔH_f, kcal/mol:	-174.32
Dipole, Da:	6.38
IP(EA), eV:	-9.26(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid

Drug info:

PubChemData

Smile

C1CN(CCN1CCC(=O)O)CCC(=O)O

DOS

IR

Vibrations