Geometry & MOs

Info

ID:	259975
PubChem CID:	103178942
Reduced:	ClNO2C13H20 (1)
Stoich.:	ABC2D13E20 (1)
Weight, g/mol:	378.03281
ΔH_f, kcal/mol:	-79.6
Dipole, Da:	3.65
IP(EA), eV:	-9.09(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-2-[2-(3-methoxypropoxy)ethoxy]ethanone

Drug info:

PubChemData

Smile

COCCCOCCNCC1=CC(=CC=C1)Cl

DOS

IR

Vibrations