Geometry & MOs

Info

ID:	126226
PubChem CID:	50955945
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	317.116427
ΔH_f, kcal/mol:	14.31
Dipole, Da:	4.56
IP(EA), eV:	-8.49(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(pyridin-2-ylmethoxy)phenyl]-7H-pyrrolo[3,4-b]pyridin-5-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=CN=C(C=C2)C3=CC=C(C=C3)C(=O)N

DOS

IR

Vibrations