Geometry & MOs

Info

ID:	260971
PubChem CID:	103211759
Reduced:	F2O2N3C9H15 (1)
Stoich.:	A2B2C3D9E15 (1)
Weight, g/mol:	406.98975
ΔH_f, kcal/mol:	-129.62
Dipole, Da:	1.6
IP(EA), eV:	-9.25(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(3-chloro-4-iodophenyl)-1,2,4-oxadiazol-3-yl]-2-propan-2-yloxyethanamine

Drug info:

PubChemData

Smile

CNCCC1=NOC(=N1)CCOCC(F)F

DOS

IR

Vibrations