Geometry & MOs

Info

ID:	159808
PubChem CID:	57288772
Reduced:	Cl2O3H8C9 (1)
Stoich.:	A2B3C8D9 (1)
Weight, g/mol:	264.111007
ΔH_f, kcal/mol:	-112.99
Dipole, Da:	0.99
IP(EA), eV:	-9.36(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-phenylacetyl) (2S)-2,5-diamino-5-oxopentanoate

Drug info:

PubChemData

Smile

CC(=O)OC1=C(C=CC(=C1OC)Cl)Cl

DOS

IR

Vibrations