Geometry & MOs

Info

ID:	220496
PubChem CID:	85195579
Reduced:	ON2C14H16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	230.090272
ΔH_f, kcal/mol:	10.97
Dipole, Da:	4.88
IP(EA), eV:	-9.15(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-(1-carboxyprop-1-enylamino)-5-oxopentanoic acid

Drug info:

PubChemData

Smile

C1CN(CCC1(C2=CC=CC=C2)O)C=CC#N

DOS

IR

Vibrations