Geometry & MOs

Info

ID:	279753
PubChem CID:	103845007
Reduced:	NOCl2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	309.04767
ΔH_f, kcal/mol:	-23.08
Dipole, Da:	2.74
IP(EA), eV:	-9.02(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)O)NCC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations