Geometry & MOs

Info

ID:	168632
PubChem CID:	74997660
Reduced:	NNaO6C27H42 (1)
Stoich.:	ABC6D27E42 (1)
Weight, g/mol:	363.143035
ΔH_f, kcal/mol:	-354.01
Dipole, Da:	6.7
IP(EA), eV:	-9.04(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(1-carboxy-3-phenylpropyl)amino]propanoyl]-2-oxoimidazolidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)NC(C1CCCCC1)C2=CC(=CC(=C2OCC(CC(CC(=O)[O-])O)O)C)C.[Na+]

DOS

IR

Vibrations