Geometry & MOs

Info

ID:

308911

PubChem CID:

126531840

Reduced:

ClFO2N8H30C31 (1)

Stoich.:

ABC2D8E30F31 (1)

Weight, g/mol:

379.129391

ΔHf, kcal/mol:

9.38

Dipole, Da:

3.1

IP(EA), eV:

 -8.55(-0.92)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-(1H-pyrazol-4-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]-4-pyridin-3-ylimidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CC1=C(C(=C2C=C(C=CC2=N1)C3=CN=C(N=C3)N4CCN(CC4)CC(=O)O)N[C@H](C)C5=C(C=CC(=C5)C6=CNN=C6)F)Cl

DOS

IR

Vibrations