Geometry & MOs

Info

ID:	257751
PubChem CID:	103148457
Reduced:	NOF3C16H22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	369.05513
ΔH_f, kcal/mol:	-205.15
Dipole, Da:	3.63
IP(EA), eV:	-8.81(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-5-methoxyphenyl)-N-methyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)CC1=CC2=C(CCC2)C=C1

DOS

IR

Vibrations