Geometry & MOs

Info

ID:	10423
PubChem CID:	101605
Reduced:	N2Cl3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	372.092682
ΔH_f, kcal/mol:	-31.55
Dipole, Da:	2.93
IP(EA), eV:	-8.94(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)-phenylmethyl]-4-methylpiperazine;dihydrochloride

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl

DOS

IR

Vibrations