Geometry & MOs

Info

ID:	282062
PubChem CID:	103915040
Reduced:	BrON2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	331.06841
ΔH_f, kcal/mol:	-29.83
Dipole, Da:	3.84
IP(EA), eV:	-8.58(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-6-methylpyridin-2-yl)-4-phenylpiperazine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)NCC2CCCO2)Br

DOS

IR

Vibrations