Geometry & MOs

Info

ID:	272528
PubChem CID:	103744577
Reduced:	BrON3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	271.027917
ΔH_f, kcal/mol:	50.69
Dipole, Da:	1.91
IP(EA), eV:	-9.62(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,6-dichlorophenyl)methyl]-2-(1,2,4-oxadiazol-5-yl)ethanamine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNCCC2=NC=NO2)Br

DOS

IR

Vibrations