Geometry & MOs

Info

ID:	81357
PubChem CID:	49854637
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-46.51
Dipole, Da:	5.44
IP(EA), eV:	-8.61(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazinan-2-one

Drug info:

PubChemData

Smile

CCN1CC2CC2(C1)C3=CC=C(C=C3)N4CCCOC4=O

DOS

IR

Vibrations