Geometry & MOs

Info

ID:	258768
PubChem CID:	103156929
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	244.142307
ΔH_f, kcal/mol:	-171.52
Dipole, Da:	4.12
IP(EA), eV:	-8.51(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-aminocyclopentanecarbonyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations