Geometry & MOs

Info

ID:	7062
PubChem CID:	71120
Reduced:	N2O8C11H16 (1)
Stoich.:	A2B8C11D16 (1)
Weight, g/mol:	304.090665
ΔH_f, kcal/mol:	-367.32
Dipole, Da:	1.67
IP(EA), eV:	-10.64(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2R)-2-acetamido-3-carboxypropanoyl]amino]pentanedioic acid

Drug info:

PubChemData

Smile

CC(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

DOS

IR

Vibrations