Geometry & MOs

Info

ID:	270369
PubChem CID:	103636276
Reduced:	NO2F3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	263.113313
ΔH_f, kcal/mol:	-239.62
Dipole, Da:	6.17
IP(EA), eV:	-8.88(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxyphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)(F)F)C1=CC=CC=C1OC

DOS

IR

Vibrations