Geometry & MOs

Info

ID:

449293

PubChem CID:

135297450

Reduced:

FN7H16C24 (1)

Stoich.:

AB7C16D24 (1)

Weight, g/mol:

478.202971

ΔHf, kcal/mol:

178.4

Dipole, Da:

3.41

IP(EA), eV:

 -8.64(-2.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[[5-[(3Z)-3-[7-(3-fluoro-5-methylphenyl)imidazo[4,5-b]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)C2=CC=NC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CN=CC=C6)NN4)/N=C23

DOS

IR

Vibrations