Geometry & MOs

Info

ID:	11784
PubChem CID:	120963
Reduced:	ClN2C22H23 (1)
Stoich.:	AB2C22D23 (1)
Weight, g/mol:	350.154976
ΔH_f, kcal/mol:	55.16
Dipole, Da:	3.04
IP(EA), eV:	-8.27(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-4-(2-naphthalen-1-ylethyl)piperazine

Drug info:

PubChemData

Smile

C1CN(CCN1CCC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations