Geometry & MOs

Info

ID:

379500

PubChem CID:

134436876

Reduced:

O3N7C28H29 (1)

Stoich.:

A3B7C28D29 (1)

Weight, g/mol:

497.217538

ΔHf, kcal/mol:

57.79

Dipole, Da:

5.01

IP(EA), eV:

 -8.44(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-(2-hydroxyethoxy)-4-[6-[6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]pyridin-3-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C[C@@H](COC1=CN2C(=C(C=N2)C#N)C(=C1)C3=CN=C(C=C3)N4CC5CC(C4)N5CC6=CN=C(C=C6)OC)O

DOS

IR

Vibrations