Geometry & MOs

Info

ID:

448074

PubChem CID:

135288232

Reduced:

FON8H21C26 (1)

Stoich.:

ABC8D21E26 (1)

Weight, g/mol:

475.186906

ΔHf, kcal/mol:

125.98

Dipole, Da:

11.35

IP(EA), eV:

 -8.63(-2.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methyl-N-[5-[(3Z)-3-(4-pyridin-2-ylimidazo[4,5-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]propanamide

Drug info:

PubChemData

Smile

CC(C)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C=CN=C(C5=N4)C6=CC(=CC(=C6)F)O

DOS

IR

Vibrations