Geometry & MOs

Info

ID:	288721
PubChem CID:	104324343
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	284.116092
ΔH_f, kcal/mol:	-41.04
Dipole, Da:	4.04
IP(EA), eV:	-8.62(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[2-(aminomethyl)-1-benzofuran-3-yl]oxy]ethyl]pyridin-2-one

Drug info:

PubChemData

Smile

CCCOC1=C(OC2=CC=CC=C21)CN

DOS

IR

Vibrations