Geometry & MOs

Info

ID:	29384
PubChem CID:	833462
Reduced:	ClNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	337.063634
ΔH_f, kcal/mol:	-47.67
Dipole, Da:	5.21
IP(EA), eV:	-8.75(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2,4-dichlorophenoxy)-N-ethyl-N-phenylpropanamide

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)Cl)C

DOS

IR

Vibrations