Geometry & MOs

Info

ID:	257412
PubChem CID:	103145966
Reduced:	O2F3N5C11H14 (1)
Stoich.:	A2B3C5D11E14 (1)
Weight, g/mol:	255.083076
ΔH_f, kcal/mol:	-154.32
Dipole, Da:	1.9
IP(EA), eV:	-9.43(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]ethanol

Drug info:

PubChemData

Smile

C1=C(NC=N1)C[C@@H](C2=NC(=NO2)CCOCC(F)(F)F)N

DOS

IR

Vibrations