Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)

Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)

In the dinuclear title complex, [Cu2(C30H38N4O2)(H2O)2](ClO4)2, the coordination cation has crystallographically imposed twofold rotational symmetry. The CuII ion is five-coordinated by two N and two O atoms from the macrocylic ligand and one O atom from a water mol­ecule, forming a square-pyramidal...

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Main Authors: Xu, Qiang, Wang, Zhaodong, He, Jiahong, Song, Zhongrong, Chen, Fengming, Meng, Jiangping, Hu, Chengbo
Format: Online
Language:English
Published: International Union of Crystallography 2012
Online Access:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414125/
id pubmed-3414125
recordtype oai_dc
spelling pubmed-34141252012-08-17 Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate) Xu, Qiang Wang, Zhaodong He, Jiahong Song, Zhongrong Chen, Fengming Meng, Jiangping Hu, Chengbo Metal-Organic Papers In the dinuclear title complex, [Cu2(C30H38N4O2)(H2O)2](ClO4)2, the coordination cation has crystallographically imposed twofold rotational symmetry. The CuII ion is five-coordinated by two N and two O atoms from the macrocylic ligand and one O atom from a water mol­ecule, forming a square-pyramidal N2O3 geometry with the water mol­ecule in the apical position. The distance between the two CuII atoms is 3.0930 (5) Å. Hydrogen bonds between water mol­ecules and between water mol­ecules and perchlorate anions assemble two cations and four anions into discrete supermolecules of S 4 symmetry. Intramolecular O—H⋯N hydrogen bonds are also observed. The perchlorate anion and the tert-butyl group are disordered over two positions, with occupancies of the major positions of 0.527 (11) and 0.592 (9), respectively. International Union of Crystallography 2012-07-14 /pmc/articles/PMC3414125/ /pubmed/22904732 http://dx.doi.org/10.1107/S1600536812031248 Text en © Xu et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
repository_type Open Access Journal
institution_category Foreign Institution
institution US National Center for Biotechnology Information
building NCBI PubMed
collection Online Access
language English
format Online
author Xu, Qiang
Wang, Zhaodong
He, Jiahong
Song, Zhongrong
Chen, Fengming
Meng, Jiangping
Hu, Chengbo
spellingShingle Xu, Qiang
Wang, Zhaodong
He, Jiahong
Song, Zhongrong
Chen, Fengming
Meng, Jiangping
Hu, Chengbo
Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
author_facet Xu, Qiang
Wang, Zhaodong
He, Jiahong
Song, Zhongrong
Chen, Fengming
Meng, Jiangping
Hu, Chengbo
author_sort Xu, Qiang
title Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
title_short Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
title_full Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
title_fullStr Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
title_full_unstemmed Diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 N 3,N 7,O 25,O 26:κ4 N 15,N 19,O 25,O 26]dicopper(II) bis­(perchlorate)
title_sort diaqua­[μ-11,23-di-tert-butyl-3,7,15,19-tetra­azatricyclo­[19.3.1.19,13]tetra­cosa-1(25),2,6,9,11,13(26),14,19,21,23-do­decaene-25,26-diolato-κ4 n 3,n 7,o 25,o 26:κ4 n 15,n 19,o 25,o 26]dicopper(ii) bis­(perchlorate)
description In the dinuclear title complex, [Cu2(C30H38N4O2)(H2O)2](ClO4)2, the coordination cation has crystallographically imposed twofold rotational symmetry. The CuII ion is five-coordinated by two N and two O atoms from the macrocylic ligand and one O atom from a water mol­ecule, forming a square-pyramidal N2O3 geometry with the water mol­ecule in the apical position. The distance between the two CuII atoms is 3.0930 (5) Å. Hydrogen bonds between water mol­ecules and between water mol­ecules and perchlorate anions assemble two cations and four anions into discrete supermolecules of S 4 symmetry. Intramolecular O—H⋯N hydrogen bonds are also observed. The perchlorate anion and the tert-butyl group are disordered over two positions, with occupancies of the major positions of 0.527 (11) and 0.592 (9), respectively.
publisher International Union of Crystallography
publishDate 2012
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414125/
_version_ 1611548307581042688

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