Geometry & MOs

Info

ID:	287217
PubChem CID:	104234069
Reduced:	BrNOF2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	281.103891
ΔH_f, kcal/mol:	-85.99
Dipole, Da:	0.61
IP(EA), eV:	-9.24(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-[2-(2,2,2-trifluoroethoxy)ethoxy]phenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=C(C=C(C=C2)Br)F)F)N

DOS

IR

Vibrations