Geometry & MOs

Info

ID:	270370
PubChem CID:	103636277
Reduced:	NO2F3C12H16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	291.144613
ΔH_f, kcal/mol:	-229.11
Dipole, Da:	2.33
IP(EA), eV:	-8.9(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(CCOCC(F)(F)F)N

DOS

IR

Vibrations