Geometry & MOs

Info

ID:	341385
PubChem CID:	127264078
Reduced:	ClN2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	313.111253
ΔH_f, kcal/mol:	-6.24
Dipole, Da:	1.57
IP(EA), eV:	-8.84(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(1-piperazin-1-ylethyl)quinoline;dihydrochloride

Drug info:

PubChemData

Smile

CC(C1=CC2=NC=CN=C2C=C1)N3CCNCC3.Cl.Cl

DOS

IR

Vibrations