Geometry & MOs

Info

ID:

266815

PubChem CID:

103579574

Reduced:

FCl2N2H5C12 (1)

Stoich.:

AB2C2D5E12 (1)

Weight, g/mol:

199.054575

ΔHf, kcal/mol:

27.44

Dipole, Da:

2.71

IP(EA), eV:

-9.88(-1.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-(5-fluoropyridin-2-yl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=NC=C1C#N)C2=CC(=C(C=C2Cl)Cl)F

DOS

IR

Vibrations