Geometry & MOs

Info

ID:

449365

PubChem CID:

135297992

Reduced:

FN8H17C24 (1)

Stoich.:

AB8C17D24 (1)

Weight, g/mol:

534.229186

ΔHf, kcal/mol:

175.25

Dipole, Da:

10.69

IP(EA), eV:

 -8.69(-2.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-[7-(3-fluoro-5-methylphenyl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]-3,3-dimethylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)C2=CN=CC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CC(=CN=C6)N)NN4)/N=C23

DOS

IR

Vibrations