Geometry & MOs

Info

ID:	259989
PubChem CID:	103179015
Reduced:	ClNO2F3C13H17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	259.139528
ΔH_f, kcal/mol:	-239.82
Dipole, Da:	7.83
IP(EA), eV:	-8.89(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxypropoxy)-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine

Drug info:

PubChemData

Smile

COCCCOCCNC1=C(C=C(C=C1)C(F)(F)F)Cl

DOS

IR

Vibrations