Geometry & MOs

Info

ID:	1765
PubChem CID:	5013
Reduced:	N3C14H17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	227.142248
ΔH_f, kcal/mol:	51.97
Dipole, Da:	2.36
IP(EA), eV:	-8.37(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpiperazin-1-yl)quinoline

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC3=CC=CC=C3C=C2

DOS

IR

Vibrations