Geometry & MOs

Info

ID:

309061

PubChem CID:

126535781

Reduced:

ON10C26H28 (1)

Stoich.:

AB10C26D28 (1)

Weight, g/mol:

599.255735

ΔHf, kcal/mol:

152.29

Dipole, Da:

10.5

IP(EA), eV:

 -8.07(-2.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-fluoro-5-[(2Z)-2-[5-(5-phenylmethoxypyridin-3-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-b]pyridin-7-yl]phenyl]-N',N'-dimethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C(=CC=NC5=N4)N6CCN(CC6)C

DOS

IR

Vibrations