Geometry & MOs

Info

ID:

211182

PubChem CID:

80907308

Reduced:

ON6C8H14 (1)

Stoich.:

AB6C8D14 (1)

Weight, g/mol:

244.087272

ΔHf, kcal/mol:

-5.78

Dipole, Da:

1.55

IP(EA), eV:

-9.09(-0.03)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-fluoro-5-[(6-hydrazinylpyrazin-2-yl)amino]benzonitrile

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NN)NC(C)C(=O)N

DOS

IR

Vibrations