Geometry & MOs

Info

ID:	271118
PubChem CID:	103643934
Reduced:	NO2F3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	301.103811
ΔH_f, kcal/mol:	-252.02
Dipole, Da:	4.25
IP(EA), eV:	-9.19(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNCC2=CC(=CC=C2)OC(F)(F)F)O

DOS

IR

Vibrations