Geometry & MOs

Info

ID:	257705
PubChem CID:	103148172
Reduced:	ClNO2F3C13H13 (1)
Stoich.:	ABC2D3E13F13 (1)
Weight, g/mol:	281.103891
ΔH_f, kcal/mol:	-213.76
Dipole, Da:	3.03
IP(EA), eV:	-9.28(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluoro-4-methoxyphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)C=C(O2)C(CCOCC(F)(F)F)N

DOS

IR

Vibrations