Geometry & MOs

Info

ID:

447967

PubChem CID:

135287167

Reduced:

N2H6C7 (4)

Stoich.:

A2B6C7 (4)

Weight, g/mol:

562.2241

ΔHf, kcal/mol:

219.53

Dipole, Da:

2.9

IP(EA), eV:

 -8.86(-2.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-cyclohexyl-N-[5-[(3Z)-3-[7-(3-fluoro-5-hydroxyphenyl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)CC2=CC(=CN=C2)C3=NC=C4C(=C3)/C(=C\5/C=C6C(=CN=CC6=N5)C7=CN=CC=C7)/NN4

DOS

IR

Vibrations