Geometry & MOs

Info

ID:

280011

PubChem CID:

103846350

Reduced:

N3C11H11 (1)

Stoich.:

A3B11C11 (1)

Weight, g/mol:

217.090292

ΔHf, kcal/mol:

71.02

Dipole, Da:

6.45

IP(EA), eV:

-8.86(-0.5)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-fluoro-6-(2-methoxyphenyl)aniline

Drug info:

PubChemData

Smile

C1=CC2=C(C=CN2CCN)C=C1C#N

DOS

IR

Vibrations