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Crystal structure of trans-(1,8-dibutyl-1,3,6,8,10,13-hexa­aza­cyclo­tetra­decane-κ(4) N (3),N (6),N (10),N (13))bis­(isonicotinato-κO)nickel(II) determined from synchrotron data

The title compound, [Ni(C(6)H(4)NO(2))(2)(C(16)H(38)N(6))], was prepared through self-assembly of a nickel(II) aza­macrocyclic complex with isonicotinic acid. The Ni(II) atom is located on an inversion center and exhibits a distorted octa­hedral N(4)O(2) coordination environment, with the four secon...

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Detalles Bibliográficos
Autores principales: Shin, Jong Won, Kim, Dae-Woong, Moon, Dohyun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4770951/
https://www.ncbi.nlm.nih.gov/pubmed/26958393
http://dx.doi.org/10.1107/S2056989016001031
Descripción
Sumario:The title compound, [Ni(C(6)H(4)NO(2))(2)(C(16)H(38)N(6))], was prepared through self-assembly of a nickel(II) aza­macrocyclic complex with isonicotinic acid. The Ni(II) atom is located on an inversion center and exhibits a distorted octa­hedral N(4)O(2) coordination environment, with the four secondary N atoms of the aza­macrocyclic ligand in the equatorial plane [average Ni—N(eq) = 2.064 (11) Å] and two O atoms of monodentate isonicotinate anions in axial positions [Ni—O(ax) = 2.137 (1) Å]. Intra­molecular N—H⋯O hydrogen bonds between one of the secondary amine N atoms of the aza­macrocyclic ligand and the non-coordinating carboxyl­ate O atom of the anion stabilize the mol­ecular structure. Inter­molecular N—H⋯N hydrogen bonds, as well as π–π inter­actions between neighbouring pyridine rings, give rise to the formations of supra­molecular ribbons extending parallel to [001].