Geometry & MOs

Info

ID:	147967
PubChem CID:	53787628
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	350.247047
ΔH_f, kcal/mol:	-149.99
Dipole, Da:	2.53
IP(EA), eV:	-8.9(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-4-[2-(4-phenylpiperazin-1-yl)ethyl]piperazine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1CCN(C1)CCCC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations