Geometry & MOs

Info

ID:	339878
PubChem CID:	127261887
Reduced:	NO6C8H15 (1)
Stoich.:	AB6C8D15 (1)
Weight, g/mol:	262.080101
ΔH_f, kcal/mol:	-279.3
Dipole, Da:	5.6
IP(EA), eV:	-10.52(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]pentanedioic acid

Drug info:

PubChemData

Smile

C(CC(=O)O)[C@@H](C(=O)O)NC[C@H](CO)O

DOS

IR

Vibrations