Geometry & MOs

Info

ID:

312818

PubChem CID:

126608899

Reduced:

OC8H12 (4)

Stoich.:

AB8C12 (4)

Weight, g/mol:

284.141245

ΔHf, kcal/mol:

-196.02

Dipole, Da:

5.31

IP(EA), eV:

-8.32(-0.64)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(4-methylphenoxy)ethyl 2,4-dimethylbenzoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)OC

DOS

IR

Vibrations