Geometry & MOs

Info

ID:	257440
PubChem CID:	103146194
Reduced:	F2O2N3C13H15 (1)
Stoich.:	A2B2C3D13E15 (1)
Weight, g/mol:	235.113233
ΔH_f, kcal/mol:	-108.82
Dipole, Da:	4.26
IP(EA), eV:	-8.78(-0.48)
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]propan-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N)CC2=NC(=NO2)CCOCC(F)F

DOS

IR

Vibrations