Geometry & MOs

Info

ID:

441382

PubChem CID:

135234444

Reduced:

FN5H14C19 (1)

Stoich.:

AB5C14D19 (1)

Weight, g/mol:

566.266634

ΔHf, kcal/mol:

84.98

Dipole, Da:

3.25

IP(EA), eV:

 -8.95(-1.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[[5-[(3Z)-3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]imidazo[4,5-b]pyridin-2-ylidene]-1,2-dihydropyrazolo[3,4-c]pyridin-5-yl]pyridin-3-yl]amino]propan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1N=CC=C2)C3=C(N=C(N=N3)N)C4=CC=C(C=C4)F

DOS

IR

Vibrations