Geometry & MOs

Info

ID:	258968
PubChem CID:	103157609
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	287.088161
ΔH_f, kcal/mol:	-43.93
Dipole, Da:	1.06
IP(EA), eV:	-8.76(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-[3-(3,4,5-trifluorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2=NOC(=N2)CC(CN)OC

DOS

IR

Vibrations