Geometry & MOs

Info

ID:	287293
PubChem CID:	104234283
Reduced:	NOF3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	237.152892
ΔH_f, kcal/mol:	-130.85
Dipole, Da:	4.5
IP(EA), eV:	-8.92(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=C(C(=CC=C2)F)F)F)NC

DOS

IR

Vibrations