Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate

In the title compound, [Cu(SO4)(C15H11N5)(H2O)]·CH3OH·2H2O, the CuII ion is in a distorted square-pyramidal geometry, in which three N atoms from the chelating 1-(1,10-phenanthrolin-2-yl)-1H-pyrazol-3-amine ligand and one O atom from a sulfate anion define the basal plane a...

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Main Authors: Liang Yuan, Liu Shu Lian, Chi Yan Hui, Zhao Yan Xia, Shi Jing Min
Format: Article
Language:English
Published: International Union of Crystallography 2012-05-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812014134
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author Liang Yuan
Liu Shu Lian
Chi Yan Hui
Zhao Yan Xia
Shi Jing Min
author_facet Liang Yuan
Liu Shu Lian
Chi Yan Hui
Zhao Yan Xia
Shi Jing Min
author_sort Liang Yuan
collection DOAJ
description In the title compound, [Cu(SO4)(C15H11N5)(H2O)]·CH3OH·2H2O, the CuII ion is in a distorted square-pyramidal geometry, in which three N atoms from the chelating 1-(1,10-phenanthrolin-2-yl)-1H-pyrazol-3-amine ligand and one O atom from a sulfate anion define the basal plane and the O atom from the coordinating water molecule is located at the apex. In the crystal, hydrogen-bonding interactions involving the coordinating and solvent water molecules, the methanol solvent molecule and the amine group (one with an intramolecular interaction to one of the sulfate O atoms) of the complex are observed. π–π interactions between symmetry-related phenantroline moieties, with a shortest centroid–centroid interaction of 3.573 (2)°, are also present.
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spelling doaj.art-b30a359c3c0a42888cdddc2214dd42fb2022-12-21T17:17:02ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-05-01685m558m55910.1107/S1600536812014134Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrateLiang YuanLiu Shu LianChi Yan HuiZhao Yan XiaShi Jing MinIn the title compound, [Cu(SO4)(C15H11N5)(H2O)]·CH3OH·2H2O, the CuII ion is in a distorted square-pyramidal geometry, in which three N atoms from the chelating 1-(1,10-phenanthrolin-2-yl)-1H-pyrazol-3-amine ligand and one O atom from a sulfate anion define the basal plane and the O atom from the coordinating water molecule is located at the apex. In the crystal, hydrogen-bonding interactions involving the coordinating and solvent water molecules, the methanol solvent molecule and the amine group (one with an intramolecular interaction to one of the sulfate O atoms) of the complex are observed. π–π interactions between symmetry-related phenantroline moieties, with a shortest centroid–centroid interaction of 3.573 (2)°, are also present.http://scripts.iucr.org/cgi-bin/paper?S1600536812014134
spellingShingle Liang Yuan
Liu Shu Lian
Chi Yan Hui
Zhao Yan Xia
Shi Jing Min
Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
Acta Crystallographica Section E
title Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
title_full Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
title_fullStr Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
title_full_unstemmed Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
title_short Aqua[1-(1,10-phenanthrolin-2-yl-κ2N,N′)-1H-pyrazol-3-amine-κN2](sulfato-κO)copper(II) methanol monosolvate dihydrate
title_sort aqua 1 1 10 phenanthrolin 2 yl amp 954 2n n amp 8242 1h pyrazol 3 amine amp 954 n2 sulfato amp 954 o copper ii methanol monosolvate dihydrate
url http://scripts.iucr.org/cgi-bin/paper?S1600536812014134
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