Geometry & MOs

Info

ID:	260616
PubChem CID:	103197548
Reduced:	O3N4C13H24 (1)
Stoich.:	A3B4C13D24 (1)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-115.59
Dipole, Da:	3.88
IP(EA), eV:	-9.44(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)(C(=NO)N)C(=O)N1CCCC(C1)C(=O)NC

DOS

IR

Vibrations