Geometry & MOs

Info

ID:

431317

PubChem CID:

135171388

Reduced:

O2N5C28H29 (1)

Stoich.:

A2B5C28D29 (1)

Weight, g/mol:

920.419425

ΔHf, kcal/mol:

27.47

Dipole, Da:

5.99

IP(EA), eV:

 -9.09(-0.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-N-[[2-[3-[[[6-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methylpyridazine-3-carbonyl]amino]methyl]-2-methylimidazo[1,2-a]pyridin-7-yl]pyrimidin-4-yl]methyl]-5-methylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN=C1N2CCC(CC2)OC3=CC=CC(=C3)C#N)C(=O)NC4CCCC5=CC=CC=C45

DOS

IR

Vibrations