Geometry & MOs

Info

ID:

447939

PubChem CID:

135287004

Reduced:

OSN8H18C22 (1)

Stoich.:

ABC8D18E22 (1)

Weight, g/mol:

605.266299

ΔHf, kcal/mol:

164.25

Dipole, Da:

5.0

IP(EA), eV:

 -8.45(-1.32)

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]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(S1)C2=NC=CC3=C2CN(N3)C4=NNC5=CN=C(C=C54)C6=CN(N=C6)C

DOS

IR

Vibrations