Geometry & MOs

Info

ID:	257469
PubChem CID:	103146419
Reduced:	SF2O2N4C12H16 (1)
Stoich.:	AB2C2D4E12F16 (1)
Weight, g/mol:	249.128883
ΔH_f, kcal/mol:	-105.87
Dipole, Da:	4.76
IP(EA), eV:	-8.96(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[2-(2,2-difluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

C1=C(N=C(S1)N)CCCC2=NC(=NO2)CCOCC(F)F

DOS

IR

Vibrations