Geometry & MOs

Info

ID:	32707
PubChem CID:	7847239
Reduced:	ClNO4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	313.108086
ΔH_f, kcal/mol:	-170.93
Dipole, Da:	0.75
IP(EA), eV:	-9.29(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(2-chlorophenoxy)acetate

Drug info:

PubChemData

Smile

C[C@H](C(C)C)NC(=O)COC(=O)COC1=CC=CC=C1Cl

DOS

IR

Vibrations