Geometry & MOs

Info

ID:	260570
PubChem CID:	103195621
Reduced:	ON5C11H17 (1)
Stoich.:	AB5C11D17 (1)
Weight, g/mol:	231.137162
ΔH_f, kcal/mol:	6.34
Dipole, Da:	4.14
IP(EA), eV:	-9.51(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(pyridin-2-ylmethyl)-2,3,4,4a,7,7a-hexahydro-1H-pyrrolo[3,4-b]pyridin-5-one

Drug info:

PubChemData

Smile

CN1C(=NC=N1)CN2CC3C(C2=O)CCCN3

DOS

IR

Vibrations