Geometry & MOs

Info

ID:

230050

PubChem CID:

87569948

Reduced:

FO4C21H25 (1)

Stoich.:

AB4C21D25 (1)

Weight, g/mol:

186.143992

ΔHf, kcal/mol:

-179.51

Dipole, Da:

5.32

IP(EA), eV:

-8.76(-0.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1=CC(=C(C(=C1C(=O)C)OC)OCCCC2=CC=C(C=C2)F)OC

DOS

IR

Vibrations