Geometry & MOs

Info

ID:

444182

PubChem CID:

135261602

Reduced:

FON8H23C27 (1)

Stoich.:

ABC8D23E27 (1)

Weight, g/mol:

503.223372

ΔHf, kcal/mol:

138.78

Dipole, Da:

4.42

IP(EA), eV:

 -8.63(-2.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-3-[4-(4-fluorophenyl)pyrrolo[3,2-c]pyridin-2-ylidene]-5-[5-(piperidin-1-ylmethyl)pyridin-3-yl]-1,2-dihydropyrazolo[3,4-c]pyridine

Drug info:

PubChemData

Smile

CN(C)CCOC1=CC(=CC(=C1)C2=NC=CC3=N/C(=C\4/C5=CC(=NC=C5NN4)C6=NC=CN=C6)/C=C32)F

DOS

IR

Vibrations