Geometry & MOs

Info

ID:	38819
PubChem CID:	8137979
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	299.092436
ΔH_f, kcal/mol:	-22.29
Dipole, Da:	1.51
IP(EA), eV:	-9.39(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(ethylamino)-1-oxopropan-2-yl] (2R)-2-(4-chlorophenoxy)propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCC(=O)NNC(=O)C2=CC=CN2

DOS

IR

Vibrations