Geometry & MOs

Info

ID:

227707

PubChem CID:

87562271

Reduced:

FNO2H16C20 (1)

Stoich.:

ABC2D16E20 (1)

Weight, g/mol:

208.02842

ΔHf, kcal/mol:

2.78

Dipole, Da:

4.71

IP(EA), eV:

-8.79(-0.88)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-fluoro-5-formylindazole-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=[N+](\C3=CC=C(C=C3)F)/[O-]

DOS

IR

Vibrations