Geometry & MOs

Info

ID:	257725
PubChem CID:	103148360
Reduced:	O2F3N3C11H16 (1)
Stoich.:	A2B3C3D11E16 (1)
Weight, g/mol:	295.119541
ΔH_f, kcal/mol:	-204.84
Dipole, Da:	5.1
IP(EA), eV:	-9.32(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)C1=NC=CN=C1OC

DOS

IR

Vibrations