Geometry & MOs

Info

ID:

448231

PubChem CID:

135289473

Reduced:

ON4H11C13 (2)

Stoich.:

AB4C11D13 (2)

Weight, g/mol:

478.168814

ΔHf, kcal/mol:

138.36

Dipole, Da:

4.87

IP(EA), eV:

 -8.67(-2.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C(=CC=NC5=N4)C6=COC=C6

DOS

IR

Vibrations