Geometry & MOs

Info

ID:

309026

PubChem CID:

126534953

Reduced:

OSF3N7H20C24 (1)

Stoich.:

ABC3D7E20F24 (1)

Weight, g/mol:

466.166585

ΔHf, kcal/mol:

-10.81

Dipole, Da:

3.95

IP(EA), eV:

 -7.98(-1.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[(2Z)-2-[5-[5-(dimethylamino)pyridin-3-yl]-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-b]pyridin-7-yl]-5-fluorophenol

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCCCN2C=C3C=CN(C3=C2)C4=C(C=C(C=C4F)F)F)C5=CN=C(C=C5)C(=O)N

DOS

IR

Vibrations