Geometry & MOs

Info

ID:	258847
PubChem CID:	103157228
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	232.142307
ΔH_f, kcal/mol:	-164.46
Dipole, Da:	9.16
IP(EA), eV:	-9.85(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[[2-methyl-2-(methylamino)propanoyl]amino]butanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)[C@H](CC1=CC=CC=C1)N

DOS

IR

Vibrations