Geometry & MOs

Info

ID:

371965

PubChem CID:

131282768

Reduced:

FNOH6C11 (1)

Stoich.:

ABCD6E11 (1)

Weight, g/mol:

291.99603

ΔHf, kcal/mol:

-19.0

Dipole, Da:

2.88

IP(EA), eV:

-9.22(-1.3)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-ethoxy-3-ethyl-5-iodophenol

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC(=C2O)C#N)C(=C1)F

DOS

IR

Vibrations