Geometry & MOs

Info

ID:	257448
PubChem CID:	103146246
Reduced:	SF2O2N3C13H15 (1)
Stoich.:	AB2C2D3E13F15 (1)
Weight, g/mol:	235.113233
ΔH_f, kcal/mol:	-107.86
Dipole, Da:	4.81
IP(EA), eV:	-8.53(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=C2C3=NC(=NO3)CCOCC(F)F)N

DOS

IR

Vibrations