Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate

Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate

In the title compound, [Cu(SO4)(C12H8N2)2]·C3H8O2, the CuII ion is bonded to two chelating 1,10-phenanthroline (phen) ligands and one O atom from a monodentate sulfate ligand in a distorted square-based pyramidal arrangement, with the O atom in a basal site. The two chelating N2C2 group...

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Main Author: Kai-Long Zhong
Format: Article
Language:English
Published: International Union of Crystallography 2012-12-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812047721
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spelling doaj-8e6a50e1ec9f479b910a4693a8cbd6002020-11-25T00:46:30ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-12-016812m1555m155510.1107/S1600536812047721Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvateKai-Long ZhongIn the title compound, [Cu(SO4)(C12H8N2)2]·C3H8O2, the CuII ion is bonded to two chelating 1,10-phenanthroline (phen) ligands and one O atom from a monodentate sulfate ligand in a distorted square-based pyramidal arrangement, with the O atom in a basal site. The two chelating N2C2 groups subtend a dihedral angle of 71.10 (15)°. In the crystal, the solvent molecule forms two O—H...O hydrogen bonds to its adjacent complex molecule. The chosen crystal was found to be a racemic twin; the presence of pseudosymmetry in the structure suggests the higher symmetry space group C2/c, but attempts to refine the structure in this space group resulted in an unsatisfactory model and high R and wR values.http://scripts.iucr.org/cgi-bin/paper?S1600536812047721
collection DOAJ
language English
format Article
sources DOAJ
author Kai-Long Zhong
spellingShingle Kai-Long Zhong
Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
Acta Crystallographica Section E
author_facet Kai-Long Zhong
author_sort Kai-Long Zhong
title Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
title_short Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
title_full Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
title_fullStr Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
title_full_unstemmed Bis(1,10-phenanthroline-κ2N,N′)(sulfato-O)copper(II) propane-1,3-diol monosolvate
title_sort bis(1,10-phenanthroline-κ2n,n′)(sulfato-o)copper(ii) propane-1,3-diol monosolvate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2012-12-01
description In the title compound, [Cu(SO4)(C12H8N2)2]·C3H8O2, the CuII ion is bonded to two chelating 1,10-phenanthroline (phen) ligands and one O atom from a monodentate sulfate ligand in a distorted square-based pyramidal arrangement, with the O atom in a basal site. The two chelating N2C2 groups subtend a dihedral angle of 71.10 (15)°. In the crystal, the solvent molecule forms two O—H...O hydrogen bonds to its adjacent complex molecule. The chosen crystal was found to be a racemic twin; the presence of pseudosymmetry in the structure suggests the higher symmetry space group C2/c, but attempts to refine the structure in this space group resulted in an unsatisfactory model and high R and wR values.
url http://scripts.iucr.org/cgi-bin/paper?S1600536812047721
work_keys_str_mv AT kailongzhong bis110phenanthrolineamp9542nnamp8242sulfatoocopperiipropane13diolmonosolvate
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