Geometry & MOs

Info

ID:	292189
PubChem CID:	114468411
Reduced:	NO2C17H35 (1)
Stoich.:	AB2C17D35 (1)
Weight, g/mol:	345.03644
ΔH_f, kcal/mol:	-143.85
Dipole, Da:	3.02
IP(EA), eV:	-8.74(1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methylamino]phenyl]ethanone

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOCC1CNCCO1

DOS

IR

Vibrations