Title of article :
Crystal structure of trans-(1,8-dibutyl-1,3,6,8,10,13-hexaazacyclotetradecane-κ4N3,N6,N10,N13)bis(isonicotinato-κO)nickel(II) determined from synchrotron data
Author/Authors :
Shin, Jong Won Beamline Department - Pohang Accelerator Laboratory 80, Republic of Korea , Kim, Dae-Woong Beamline Department - Pohang Accelerator Laboratory 80, Republic of Korea , Moon, Dohyun Beamline Department - Pohang Accelerator Laboratory 80, Republic of Korea
Abstract :
The title compound, [Ni(C6H4NO2)2(C16H38N6)], was prepared through self-assembly of a nickel(II) azamacrocyclic complex with isonicotinic acid. The NiII atom is located on an inversion center and exhibits a distorted octahedral N4O2 coordination environment, with the four secondary N atoms of the azamacrocyclic ligand in the equatorial plane [average Ni—Neq = 2.064 (11) Å] and two O atoms of monodentate isonicotinate anions in axial positions [Ni—Oax = 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].
Keywords :
crystal structure , azamacrocyclic ligand , isonicotinic acid , π–π interactions
Journal title :
Acta Crystallographica Section E: Crystallographic Communications