Geometry & MOs

Info

ID:	270376
PubChem CID:	103636290
Reduced:	NOF4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	301.090133
ΔH_f, kcal/mol:	-231.16
Dipole, Da:	3.55
IP(EA), eV:	-9.4(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2,2-trifluoroethoxy)-1-[3-(trifluoromethyl)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)C1=CC(=CC=C1)F

DOS

IR

Vibrations