Geometry & MOs

Info

ID:	257740
PubChem CID:	103148427
Reduced:	ClNO2F3C14H15 (1)
Stoich.:	ABC2D3E14F15 (1)
Weight, g/mol:	305.160263
ΔH_f, kcal/mol:	-212.66
Dipole, Da:	2.34
IP(EA), eV:	-9.37(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-5-methylphenyl)-N-methyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)C1=CC2=C(O1)C=CC(=C2)Cl

DOS

IR

Vibrations