Geometry & MOs

Info

ID:	272530
PubChem CID:	103744579
Reduced:	FO2N3H14C15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	271.093247
ΔH_f, kcal/mol:	-7.29
Dipole, Da:	1.31
IP(EA), eV:	-8.95(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CC=C(O2)CNCCC3=NC=NO3)F

DOS

IR

Vibrations