Geometry & MOs

Info

ID:	258104
PubChem CID:	103151002
Reduced:	SO2F3N3C11H16 (1)
Stoich.:	AB2C3D3E11F16 (1)
Weight, g/mol:	295.150761
ΔH_f, kcal/mol:	-182.11
Dipole, Da:	4.23
IP(EA), eV:	-8.94(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]butan-2-amine

Drug info:

PubChemData

Smile

CNC1CSCC1C2=NC(=NO2)CCOCC(F)(F)F

DOS

IR

Vibrations