Geometry & MOs

Info

ID:	270225
PubChem CID:	103635505
Reduced:	OSF3N3C13H14 (1)
Stoich.:	ABC3D3E13F14 (1)
Weight, g/mol:	301.103811
ΔH_f, kcal/mol:	-126.02
Dipole, Da:	6.1
IP(EA), eV:	-9.58(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CCNCC2=CC=C(C=C2)SC(F)(F)F

DOS

IR

Vibrations