Geometry & MOs

Info

ID:

7025

PubChem CID:

71006

Reduced:

O2C5H5 (2)

Stoich.:

A2B5C5 (2)

Weight, g/mol:

194.057909

ΔHf, kcal/mol:

-151.09

Dipole, Da:

0.54

IP(EA), eV:

-9.05(-0.22)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4-acetyloxyphenyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)OC(=O)C

DOS

IR

Vibrations