{4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate

The asymmetric unit of the title compound, [Cu(C21H24N2O2)]·H2O, comprises half of a Schiff base complex and half of a water molecule. The whole compound is generated by crystallographic twofold rotation symmetry. The geometry around the CuII atom, located on a twofold axis, is distorte...

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Main Authors: Hadi Kargar, Reza Kia, Fatemeh Ganji, Valiollah Mirkhani
Format: Article
Language:English
Published: International Union of Crystallography 2012-09-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812034502
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author Hadi Kargar
Reza Kia
Fatemeh Ganji
Valiollah Mirkhani
author_facet Hadi Kargar
Reza Kia
Fatemeh Ganji
Valiollah Mirkhani
author_sort Hadi Kargar
collection DOAJ
description The asymmetric unit of the title compound, [Cu(C21H24N2O2)]·H2O, comprises half of a Schiff base complex and half of a water molecule. The whole compound is generated by crystallographic twofold rotation symmetry. The geometry around the CuII atom, located on a twofold axis, is distorted square-planar, which is supported by the N2O2 donor atoms of the coordinating Schiff base ligand. The dihedral angle between the symmetry-related benzene rings is 47.5 (4)°. In the crystal, the water molecule that is hydrogen bonded to the coordinated O atoms links the molecules via O—H...O interactions into chains parallel to [001]. The crystal structure is further stabilized by C—H...π interactions, and by π–π interactions involving inversion-related chelate rings [centroid–centroid distance = 3.480 (4) Å].
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spelling doaj.art-cf23b22eb04f4982a64a200a7c1e5ba72022-12-22T04:15:01ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-09-01689m1172m117210.1107/S1600536812034502{4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrateHadi KargarReza KiaFatemeh GanjiValiollah MirkhaniThe asymmetric unit of the title compound, [Cu(C21H24N2O2)]·H2O, comprises half of a Schiff base complex and half of a water molecule. The whole compound is generated by crystallographic twofold rotation symmetry. The geometry around the CuII atom, located on a twofold axis, is distorted square-planar, which is supported by the N2O2 donor atoms of the coordinating Schiff base ligand. The dihedral angle between the symmetry-related benzene rings is 47.5 (4)°. In the crystal, the water molecule that is hydrogen bonded to the coordinated O atoms links the molecules via O—H...O interactions into chains parallel to [001]. The crystal structure is further stabilized by C—H...π interactions, and by π–π interactions involving inversion-related chelate rings [centroid–centroid distance = 3.480 (4) Å].http://scripts.iucr.org/cgi-bin/paper?S1600536812034502
spellingShingle Hadi Kargar
Reza Kia
Fatemeh Ganji
Valiollah Mirkhani
{4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
Acta Crystallographica Section E
title {4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
title_full {4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
title_fullStr {4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
title_full_unstemmed {4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
title_short {4,4′-Dimethyl-2,2′-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}copper(II) monohydrate
title_sort 4 4 amp 8242 dimethyl 2 2 amp 8242 2 2 dimethylpropane 1 3 diylbis nitrilomethanylylidene diphenolato copper ii monohydrate
url http://scripts.iucr.org/cgi-bin/paper?S1600536812034502
work_keys_str_mv AT hadikargar 44amp8242dimethyl22amp824222dimethylpropane13diylbisnitrilomethanylylidenediphenolatocopperiimonohydrate
AT rezakia 44amp8242dimethyl22amp824222dimethylpropane13diylbisnitrilomethanylylidenediphenolatocopperiimonohydrate
AT fatemehganji 44amp8242dimethyl22amp824222dimethylpropane13diylbisnitrilomethanylylidenediphenolatocopperiimonohydrate
AT valiollahmirkhani 44amp8242dimethyl22amp824222dimethylpropane13diylbisnitrilomethanylylidenediphenolatocopperiimonohydrate