Table 5. Dipole Moment of the Structures (debye) in Six Different Basis Sets; c (Docking N–H···:O), d (Docking O–H···:N), f (the Open-Chain Structure with 2-Docking N–H···:O), g (3-Fold), h (3-Fold and Docking), i (4-Fold), j (4-Fold and Docking), k (5-Fold), l (5-Fold and Docking), and m (6-Fold)^a.

	basis sets
cluster	DFT/B3LYP/6-311++G**	DFT/B3LYP/6-311+G**	DFT/B3LYP/6-31+G*	DFT/B3LYP/6-311G*	DFT/B3LYP/6-31G**	DFT/B3LYP/6-31G*
d	2.40	2.41	2.43	3.02	2.65	2.62
c	4.28	4.29	4.37	4.15	4.08	4.11
f	4.90	4.91	5.78	5.08	5.49	5.63
g	2.24	2.20	2.42	2.17	2.37	2.36
h	4.07	4.03	4.48	4.21	4.33	4.42
i	2.21	2.20	2.43	2.02	2.27	2.24
j	3.90	3.94	4.53	4.09	4.44	4.54
k	2.21	2.30	2.67	2.18	2.52	2.49
L	3.74	3.70	4.40	4.05	4.56	4.64
M	2.27	2.25	2.61	2.07	1.92	1.80

^a.