Geometry & MOs

Info

ID:	32581
PubChem CID:	7846033
Reduced:	ClNO4C21H22 (1)
Stoich.:	ABC4D21E22 (1)
Weight, g/mol:	381.053463
ΔH_f, kcal/mol:	-141.84
Dipole, Da:	3.56
IP(EA), eV:	-8.72(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(4-chloroanilino)-1-oxopropan-2-yl] 2-(4-chloro-3-methylphenoxy)acetate

Drug info:

PubChemData

Smile

C[C@@H]1CC2=CC=CC=C2N1C(=O)[C@@H](C)OC(=O)COC3=CC(=C(C=C3)Cl)C

DOS

IR

Vibrations