Geometry & MOs

Info

ID:	280922
PubChem CID:	103851969
Reduced:	ClFON3C11H11 (1)
Stoich.:	ABCD3E11F11 (1)
Weight, g/mol:	289.083825
ΔH_f, kcal/mol:	-7.21
Dipole, Da:	3.09
IP(EA), eV:	-9.71(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-2-(1,2,4-oxadiazol-5-yl)ethanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CNCCC2=NC=NO2)Cl)F

DOS

IR

Vibrations