Geometry & MOs

Info

ID:

426929

PubChem CID:

135154582

Reduced:

PF3O4N7C25H35 (1)

Stoich.:

AB3C4D7E25F35 (1)

Weight, g/mol:

408.216141

ΔHf, kcal/mol:

-332.18

Dipole, Da:

5.35

IP(EA), eV:

 -9.08(-0.52)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

cyclopropyl-[2-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-3-methyl-5,7-dihydropyrrolo[3,4-b]pyridin-6-yl]methanone

Drug info:

PubChemData

Smile

CCCOC(=O)C(C)(C)NP(=O)(CO[C@@H](C)CN1C=NC2=C(N=CN=C21)N)N[C@H](C3=CC=C(C=C3)C)C(F)(F)F

DOS

IR

Vibrations