Geometry & MOs

Info

ID:

447821

PubChem CID:

135286005

Reduced:

ON7H19C24 (1)

Stoich.:

AB7C19D24 (1)

Weight, g/mol:

542.186652

ΔHf, kcal/mol:

180.93

Dipole, Da:

6.53

IP(EA), eV:

 -8.46(-2.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-3-[4-(3-fluoro-5-methoxyphenyl)pyrrolo[3,2-c]pyridin-2-ylidene]-5-(5-phenylmethoxypyridin-3-yl)-1,2-dihydropyrazolo[3,4-b]pyridine

Drug info:

PubChemData

Smile

CN(C)C1=CN=CC(=C1)C2=CC\3=C(NN/C3=C\4/C=C5C(=N4)C=CN=C5C6=COC=C6)N=C2

DOS

IR

Vibrations