Geometry & MOs

Info

ID:

412572

PubChem CID:

135085469

Reduced:

NO2C12H15 (1)

Stoich.:

AB2C12D15 (1)

Weight, g/mol:

228.078644

ΔHf, kcal/mol:

-32.42

Dipole, Da:

1.74

IP(EA), eV:

-8.67(-0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-phenylprop-2-enyl furan-2-carboxylate

Drug info:

PubChemData

Smile

CCCC#CC1C=CC=CN1C(=O)OC

DOS

IR

Vibrations