Geometry & MOs

Info

ID:

150948

PubChem CID:

53790645

Reduced:

Cl2O3C5H9 (1)

Stoich.:

A2B3C5D9 (1)

Weight, g/mol:

185.98505

ΔHf, kcal/mol:

-132.42

Dipole, Da:

5.05

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.757279

Charge, e:

 0

Chem-info

IUPAC name:

2-methoxyethyl 2,2-dichloroacetate

Drug info:

PubChemData

Smile

C[OH+]CCOC(=O)C(Cl)Cl

DOS

IR

Vibrations