Geometry & MOs

Info

ID:	39192
PubChem CID:	8139893
Reduced:	NCl2O4C19H19 (1)
Stoich.:	AB2C4D19E19 (1)
Weight, g/mol:	395.069114
ΔH_f, kcal/mol:	-150.07
Dipole, Da:	3.05
IP(EA), eV:	-9.64(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(ethylamino)-1-oxopropan-2-yl] 2-[(2,4-dichlorophenyl)methoxy]benzoate

Drug info:

PubChemData

Smile

CCNC(=O)[C@@H](C)OC(=O)C1=CC=CC=C1OCC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations