Geometry & MOs

Info

ID:

449493

PubChem CID:

135299067

Reduced:

N7H19C25 (1)

Stoich.:

A7B19C25 (1)

Weight, g/mol:

460.212393

ΔHf, kcal/mol:

214.83

Dipole, Da:

9.19

IP(EA), eV:

 -8.52(-2.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(3E)-3-[4-(3-methylphenyl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]-N-propan-2-ylpyridin-3-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NC=CC3=N/C(=C\4/C5=C(C=CC(=N5)C6=C(C=CN=C6)C)NN4)/N=C32

DOS

IR

Vibrations