Geometry & MOs

Info

ID:

338328

PubChem CID:

127259020

Reduced:

N2O3C11H16 (1)

Stoich.:

A2B3C11D16 (1)

Weight, g/mol:

298.156895

ΔHf, kcal/mol:

-125.15

Dipole, Da:

3.54

IP(EA), eV:

-9.09(-0.2)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3-pentoxy-4-phenylphenyl) acetate

Drug info:

PubChemData

Smile

CC(=O)O/C=C/1\C(=O)NC2CCCCC2N1

DOS

IR

Vibrations