Crystal structure of <i>trans</i> -(1,8-dibutyl-1,3,6,8,10,13-hexaazacyclotetradecane-κ <sup>4</sup> <i>N</i> <sup>3</sup> , <i>N</i> <sup>6</sup> , <i>N</i> <sup>10</sup> , <i>N</i> <sup>13</sup> )bis(perchlorato-κ <i>O</i> )nickel(II) from synchrot

The crystal structure of the nickel(II) macrocyclic title complex, <i>trans</i>- [Ni(ClO<sub>4</sub>)<sub>2</sub>(C<sub>16</sub>H<sub>38</sub>N<sub>6</sub>)], was analyzed using synchrotron radiation. The coordination environment consists of four nitro-gen atoms from the ligand [Ni-N = 1.9382 (16), 1.9378 (17) Å] and two perchlorate oxygen atoms [Ni-O = 2.878 (3) Å], adopting an octa-hedral geometry with slight tetra-gonal distortion. The structural comparison with its Cu<sup>II</sup> analogue reveals a notable elongation in the axial Ni-O bonds, which is attributed to the steric hindrance of the macrocyclic ligand and weak axial coordination. Supra-molecular inter-actions involving hydrogen bonding further consolidate the three-dimensional crystal packing.

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Publication Details

Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2026-02-23
DOI
https://doi.org/10.1107/s2056989026001817
Primary Topic
Metal-Catalyzed Oxygenation Mechanisms
Type
article
Field-Weighted Citation Impact
0.00

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article

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(perchlorato-κ O )nickel(II) from synchrot

Dongwon Kim, Dae-Woong Kim, Dohyun Moon
Acta Crystallographica Section E Crystallographic Communications
Metal-Catalyzed Oxygenation Mechanisms
article

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(perchlorato-κ O )nickel(II) from synchrot

Dongwon Kim, Dae-Woong Kim, Dohyun Moon
article en

Abstract

The crystal structure of the nickel(II) macrocyclic title complex, <i>trans</i>- [Ni(ClO<sub>4</sub>)<sub>2</sub>(C<sub>16</sub>H<sub>38</sub>N<sub>6</sub>)], was analyzed using synchrotron radiation. The coordination environment consists of four nitro-gen atoms from the ligand [Ni-N = 1.9382 (16), 1.9378 (17) Å] and two perchlorate oxygen atoms [Ni-O = 2.878 (3) Å], adopting an octa-hedral geometry with slight tetra-gonal distortion. The structural comparison with its Cu<sup>II</sup> analogue reveals a notable elongation in the axial Ni-O bonds, which is attributed to the steric hindrance of the macrocyclic ligand and weak axial coordination. Supra-molecular inter-actions involving hydrogen bonding further consolidate the three-dimensional crystal packing.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 82(3)
Pohang University of Science and Technology (KR), Pohang TechnoPark (South Korea) (KR)
National Research Foundation, Pohang University of Science and Technology, Ministry of Science, ICT and Future Planning, National Research Foundation of Korea, Ministry of Education, Science and Technology, Ministry of Science and ICT, South Korea
Openalex Percentile: Top 45%
Metal-Catalyzed Oxygenation Mechanisms
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