Geometry & MOs

Info

ID:

309050

PubChem CID:

126535439

Reduced:

ON4H10C13 (2)

Stoich.:

AB4C10D13 (2)

Weight, g/mol:

490.202971

ΔHf, kcal/mol:

173.82

Dipole, Da:

9.13

IP(EA), eV:

 -8.45(-2.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C(=CC=NC5=N4)C6=CC7=C(C=C6)OCO7

DOS

IR

Vibrations