Geometry & MOs

Info

ID:	257837
PubChem CID:	103148764
Reduced:	O2F3N3C13H22 (1)
Stoich.:	A2B3C3D13E22 (1)
Weight, g/mol:	290.160598
ΔH_f, kcal/mol:	-212.28
Dipole, Da:	1.78
IP(EA), eV:	-8.63(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylpyridin-3-yl)-N-propyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)(F)F)C1=C(C=NN1C)OC

DOS

IR

Vibrations