Geometry & MOs

Info

ID:	257689
PubChem CID:	103147995
Reduced:	ON2F3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	291.144613
ΔH_f, kcal/mol:	-166.03
Dipole, Da:	3.0
IP(EA), eV:	-9.07(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-propan-2-yloxyphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C=C(C=C2)C(CCOCC(F)(F)F)N

DOS

IR

Vibrations