Geometry & MOs

Info

ID:

267957

PubChem CID:

103590866

Reduced:

FN4C11H13 (1)

Stoich.:

AB4C11D13 (1)

Weight, g/mol:

261.080121

ΔHf, kcal/mol:

3.13

Dipole, Da:

1.26

IP(EA), eV:

-8.69(-0.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yloxy)-5-fluoro-4-methylaniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)N2C(=NC(=N2)C)C

DOS

IR

Vibrations