Geometry & MOs

Info

ID:

449310

PubChem CID:

135297537

Reduced:

N5H11C13 (2)

Stoich.:

A5B11C13 (2)

Weight, g/mol:

501.227709

ΔHf, kcal/mol:

256.93

Dipole, Da:

7.92

IP(EA), eV:

 -8.56(-2.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-(5-cyclohexyloxypyridin-3-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]-7-(3-methylphenyl)imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC=NC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CN=CC(=N6)N7CC(C7)N)NN4)/N=C23

DOS

IR

Vibrations