Geometry & MOs

Info

ID:

582

PubChem CID:

3032

Reduced:

NCl2O2H10C14 (1)

Stoich.:

AB2C2D10E14 (1)

Weight, g/mol:

294.008859

ΔHf, kcal/mol:

-34.0

Dipole, Da:

6.95

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.443781

Charge, e:

 -1

Chem-info

IUPAC name:

2-[2-(2,6-dichloroanilino)phenyl]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl

DOS

IR

Vibrations