Geometry & MOs

Info

ID:

447953

PubChem CID:

135287119

Reduced:

N9H21C22 (1)

Stoich.:

A9B21C22 (1)

Weight, g/mol:

591.250649

ΔHf, kcal/mol:

209.13

Dipole, Da:

7.2

IP(EA), eV:

 -8.18(-2.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-[7-[3-[2-(dimethylamino)ethoxy]-5-fluorophenyl]imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=CN=CC3=N/C(=C/4\C5=C(NN4)N=CC(=C5)C6=CN=CN=C6)/C=C23

DOS

IR

Vibrations