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Crystal structure of trans -di-aqua-(3,10-dimethyl-1,3,5,8,10,12-hexa-aza-cyclo-tetra-deca-ne)copper(II) pamoate.

Authors :
Tsymbal LV
Andriichuk IL
Arion VB
Lampeka YD
Source :
Acta crystallographica. Section E, Crystallographic communications [Acta Crystallogr E Crystallogr Commun] 2019 Apr 02; Vol. 75 (Pt 5), pp. 533-536. Date of Electronic Publication: 2019 Apr 02 (Print Publication: 2019).
Publication Year :
2019

Abstract

The asymmetric unit of the title compound, trans -di-aqua-(3,10-dimethyl-1,3,5,8,10,12-hexa-aza-cyclo-tetra-decane-Îș <superscript>4</superscript> N <superscript>1</superscript> , N <superscript>5</superscript> , N <superscript>8</superscript> , N <superscript>12</superscript> )copper(II) 4,4'-methyl-ene-bis(3-hy-droxy-naphthalene-2-carboxyl-ate), [Cu(C <subscript>10</subscript> H <subscript>26</subscript> N <subscript>6</subscript> )(H <subscript>2</subscript> O) <subscript>2</subscript> ](C <subscript>23</subscript> H <subscript>14</subscript> O <subscript>6</subscript> ) {[Cu( L )(H <subscript>2</subscript> O) <subscript>2</subscript> ](pam), where L = 3,10-dimethyl-1,3,5,8,10,12-hexa-aza-cyclo-tetra-decane and pam = dianion of pamoic acid} consists of two independent halves of the [Cu( L )(H <subscript>2</subscript> O) <subscript>2</subscript> ] <superscript>2+</superscript> cation and one di-carboxyl-ate anion. The Cu <superscript>II</superscript> atoms, lying on inversion centres, are coordinated by the four secondary N atoms of the macrocyclic ligands and the mutually trans O atoms of the water mol-ecules in a tetra-gonally elongated octa-hedral geometry. The average equatorial Cu-N bond length is significantly shorter than the average axial Cu-O bond length [2.007 (10) and 2.486 (18) Å, respectively]. The macrocyclic ligand in the complex cations adopts the most energetically stable trans -III conformation. The complex cations and anions are connected via hydrogen-bonding inter-actions between the N-H groups of the macrocycles and the O-H groups of coordinated water mol-ecules as the proton donors and the O atoms of the carboxyl-ate as the proton acceptors into layers lying parallel to the (11) plane.

Details

Language :
English
ISSN :
2056-9890
Volume :
75
Issue :
Pt 5
Database :
MEDLINE
Journal :
Acta crystallographica. Section E, Crystallographic communications
Publication Type :
Academic Journal
Accession number :
31110779
Full Text :
https://doi.org/10.1107/S2056989019003852