Geometry & MOs

Info

ID:	32700
PubChem CID:	7847214
Reduced:	NCl2O4H15C17 (1)
Stoich.:	AB2C4D15E17 (1)
Weight, g/mol:	361.108086
ΔH_f, kcal/mol:	-130.67
Dipole, Da:	6.95
IP(EA), eV:	-9.21(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] 2-(2-chlorophenoxy)acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC(=CC=C1)Cl)OC(=O)COC2=CC=CC=C2Cl

DOS

IR

Vibrations