Geometry & MOs

Info

ID:

309024

PubChem CID:

126534901

Reduced:

FO2N7H16C24 (1)

Stoich.:

AB2C7D16E24 (1)

Weight, g/mol:

505.202637

ΔHf, kcal/mol:

104.91

Dipole, Da:

10.56

IP(EA), eV:

 -8.77(-2.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-(5-cyclohexyloxypyridin-3-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]-7-(4-fluorophenyl)imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C2=CC=NC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CC(=CN=C6)O)NN4)/N=C23)F

DOS

IR

Vibrations