Geometry & MOs

Info

ID:

57317

PubChem CID:

22395651

Reduced:

O4C5H9 (1)

Stoich.:

A4B5C9 (1)

Weight, g/mol:

162.089209

ΔHf, kcal/mol:

-142.68

Dipole, Da:

4.08

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.779169

Charge, e:

 0

Chem-info

IUPAC name:

ethyl acetate;methyl acetate

Drug info:

PubChemData

Smile

CC(=O)[O-].CC(=O)OC

DOS

IR

Vibrations