Geometry & MOs

Info

ID:	257759
PubChem CID:	103148494
Reduced:	OF3N3C11H18 (1)
Stoich.:	AB3C3D11E18 (1)
Weight, g/mol:	357.03514
ΔH_f, kcal/mol:	-171.49
Dipole, Da:	4.14
IP(EA), eV:	-9.06(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-fluorophenyl)-N-ethyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)C1=CN(N=C1)C

DOS

IR

Vibrations