Geometry & MOs

Info

ID:	248660
PubChem CID:	103083361
Reduced:	BrON3C15H18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	343.03202
ΔH_f, kcal/mol:	30.75
Dipole, Da:	2.22
IP(EA), eV:	-9.2(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[3-(4-bromo-2-methylphenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=NOC(=N2)C3(CCNCC3)C

DOS

IR

Vibrations