Selected bond lengths (μM-Oeq, M-Nax, in Å) and dihedral and endocyclic metal angles (in °) of the optimized unbound metal-complexes with tetradentate coordination.
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https://figshare.com/articles/dataset/Selected_bond_lengths_M-O_sub_eq_sub_M-N_sub_ax_sub_in_and_dihedral_and_endocyclic_metal_angles_in_of_the_optimized_unbound_metal-complexes_with_tetradentate_coordination_/27182032
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Relative tridentate-tetradentate energies (ΔEtri/tetra) are also included, with positive values (in kcal∙mol-1) indicating a preference for a tetradentate coordination and vice versa.
创建时间：
2024-10-07
