Geometry & MOs

Info

ID:	11758
PubChem CID:	120549
Reduced:	N2C21H22 (1)
Stoich.:	A2B21C22 (1)
Weight, g/mol:	302.178299
ΔH_f, kcal/mol:	71.46
Dipole, Da:	1.69
IP(EA), eV:	-8.14(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(naphthalen-1-ylmethyl)-4-phenylpiperazine

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C4=CC=CC=C4

DOS

IR

Vibrations