Geometry & MOs

Info

ID:

432941

PubChem CID:

135173078

Reduced:

NH27C42 (1)

Stoich.:

AB27C42 (1)

Weight, g/mol:

427.155686

ΔHf, kcal/mol:

184.19

Dipole, Da:

1.79

IP(EA), eV:

 -8.68(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(E)-2-fluoro-2-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-5-methylidenepyrazol-4-yl]-N-methyl-1-(4-methylpyridin-3-yl)ethenamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C(C=CC=C42)C5=CC6=C(C=C5)C7=CC=CC=C7C8=CC=CC=C86)C9=CC=CC=N9

DOS

IR

Vibrations