Topology parameters, including electron density (ρ), Laplacian electron density (∇²ρ), potential energy density [V(r)], total energy density [H(r)], and hydrogen bonding energy [E_HB(kcal mol⁻¹)] at the bond critical point of non-covalent interactions (D⋯HA) for conformers 1A and 1B at the B3LYP/6-31++G** level.

Compound	Interactions	BCP	d (Å)	∠D⋯HA	∇2ρ	V(r)	G(r)	H(r)	E HB
1A
	N⋯HO	(3, −1)	1.68	146.77	0.1303	−0.0452	0.0419	−0.0063	−14.18
	ArH⋯N	(3, −1)	2.19	129.10	0.0637	−0.0131	0.0145	−0.0014	−4.11
1B
	N⋯HO	(3, −1)	1.59	166.51	0.1295	−0.0581	0.0453	−0.0129	−18.22
	ArH⋯N	(3, −1)	2.25	102.36	0.0812	−0.0137	0.0170	−0.0033	−4.39