Geometry & MOs

Info

ID:

228874

PubChem CID:

87566035

Reduced:

O7C10H20 (1)

Stoich.:

A7B10C20 (1)

Weight, g/mol:

419.071147

ΔHf, kcal/mol:

-331.49

Dipole, Da:

6.9

IP(EA), eV:

-10.64(-0.1)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-chloro-3-(5,5,6,6,6-pentafluorohexoxy)-2H-acridin-1-one

Drug info:

PubChemData

Smile

CCCCOC(CC(=O)O)C(=O)O.C(CO)O

DOS

IR

Vibrations