Geometry & MOs

Info

ID:	258894
PubChem CID:	103157365
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	248.137222
ΔH_f, kcal/mol:	-93.46
Dipole, Da:	2.62
IP(EA), eV:	-9.13(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-amino-4-methoxybutanoyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1CNCC(CC2CCCC2)O

DOS

IR

Vibrations