Geometry & MOs

Info

ID:	258691
PubChem CID:	103156423
Reduced:	N2O6C9H16 (1)
Stoich.:	A2B6C9D16 (1)
Weight, g/mol:	218.126657
ΔH_f, kcal/mol:	-269.17
Dipole, Da:	5.96
IP(EA), eV:	-9.79(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(4-amino-3-methoxybutanoyl)amino]butanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)NC(CC(=O)O)C(=O)O)CN

DOS

IR

Vibrations