(2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate

(2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate

In the title compound, [Y(C5H2N2O4)(C5H3N2O4)(C12H8N2)2]·2H2O, the YIII ion lies on a twofold rotation axis and exhibits a distorted square-antiprismatic coordination geometry. It is chelated by two 1,10-phenanthroline ligands, a 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate monoanio...

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Main Authors: Zilu Chen, Yan Su, Huihui Xing, Wei Xiong
Format: Article
Language:English
Published: International Union of Crystallography 2008-09-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536808025701
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spelling doaj-0056eae889654d329dc307da26176fce2020-11-25T01:10:55ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-09-01649m1166m116710.1107/S1600536808025701(2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrateZilu ChenYan SuHuihui XingWei XiongIn the title compound, [Y(C5H2N2O4)(C5H3N2O4)(C12H8N2)2]·2H2O, the YIII ion lies on a twofold rotation axis and exhibits a distorted square-antiprismatic coordination geometry. It is chelated by two 1,10-phenanthroline ligands, a 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate monoanion and a 4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylate dianion. The H atom involved in an N—H...N hydrogen bond between the 1,2-dihydropyrimidine units has half occupancy and is disordered around a twofold rotation axis.http://scripts.iucr.org/cgi-bin/paper?S1600536808025701
collection DOAJ
language English
format Article
sources DOAJ
author Zilu Chen
Yan Su
Huihui Xing
Wei Xiong
spellingShingle Zilu Chen
Yan Su
Huihui Xing
Wei Xiong
(2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
Acta Crystallographica Section E
author_facet Zilu Chen
Yan Su
Huihui Xing
Wei Xiong
author_sort Zilu Chen
title (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
title_short (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
title_full (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
title_fullStr (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
title_full_unstemmed (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2O4,O5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2O4,O5)bis(1,10-phenanthroline-κ2N,N′)yttrium(III) dihydrate
title_sort (2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ2o4,o5)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ2o4,o5)bis(1,10-phenanthroline-κ2n,n′)yttrium(iii) dihydrate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2008-09-01
description In the title compound, [Y(C5H2N2O4)(C5H3N2O4)(C12H8N2)2]·2H2O, the YIII ion lies on a twofold rotation axis and exhibits a distorted square-antiprismatic coordination geometry. It is chelated by two 1,10-phenanthroline ligands, a 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate monoanion and a 4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylate dianion. The H atom involved in an N—H...N hydrogen bond between the 1,2-dihydropyrimidine units has half occupancy and is disordered around a twofold rotation axis.
url http://scripts.iucr.org/cgi-bin/paper?S1600536808025701
work_keys_str_mv AT ziluchen 24dioxo1234tetrahydropyrimidine5carboxylato9542o4o54oxido2oxo12dihydropyrimidine5carboxylato9542o4o5bis110phenanthroline9542nn8242yttriumiiidihydrate
AT yansu 24dioxo1234tetrahydropyrimidine5carboxylato9542o4o54oxido2oxo12dihydropyrimidine5carboxylato9542o4o5bis110phenanthroline9542nn8242yttriumiiidihydrate
AT huihuixing 24dioxo1234tetrahydropyrimidine5carboxylato9542o4o54oxido2oxo12dihydropyrimidine5carboxylato9542o4o5bis110phenanthroline9542nn8242yttriumiiidihydrate
AT weixiong 24dioxo1234tetrahydropyrimidine5carboxylato9542o4o54oxido2oxo12dihydropyrimidine5carboxylato9542o4o5bis110phenanthroline9542nn8242yttriumiiidihydrate
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