Geometry & MOs

Info

ID:

448229

PubChem CID:

135289468

Reduced:

O3N8H26C30 (1)

Stoich.:

A3B8C26D30 (1)

Weight, g/mol:

462.191657

ΔHf, kcal/mol:

129.92

Dipole, Da:

9.68

IP(EA), eV:

 -8.46(-2.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(3Z)-3-[7-(3-methoxyphenyl)imidazo[4,5-b]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]-N,N-dimethylpyridin-3-amine

Drug info:

PubChemData

Smile

C1CCN(C1)CCOC2=CN=CC(=C2)C3=NC\4=C(C=C3)NN/C4=C\5/N=C6C(=CC=NC6=N5)C7=CC8=C(C=C7)OCO8

DOS

IR

Vibrations