Geometry & MOs

Info

ID:

448075

PubChem CID:

135288237

Reduced:

ON9H21C26 (1)

Stoich.:

AB9C21D26 (1)

Weight, g/mol:

496.123007

ΔHf, kcal/mol:

190.23

Dipole, Da:

5.38

IP(EA), eV:

 -8.59(-2.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-[4-(5-fluorothiophen-2-yl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C=CN=C(C5=N4)C6=CC=CC=N6

DOS

IR

Vibrations