Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate

In the title complex, [Cd(C10H5O8)2(C10H9N5)2(H2O)2]·2H2O, the CdII ion lies on an inversion center and is coordinated by two N atoms from two symmetry-related 1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole ligands and two O atoms from two monodeprotonated 2,4,5-tricarboxybenzoate a...

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Main Authors: Lei Zhao, Bingtao Liu, Guanghua Jin, Xiangru Meng
Format: Article
Language:English
Published: International Union of Crystallography 2012-02-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812000384
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author Lei Zhao
Bingtao Liu
Guanghua Jin
Xiangru Meng
author_facet Lei Zhao
Bingtao Liu
Guanghua Jin
Xiangru Meng
author_sort Lei Zhao
collection DOAJ
description In the title complex, [Cd(C10H5O8)2(C10H9N5)2(H2O)2]·2H2O, the CdII ion lies on an inversion center and is coordinated by two N atoms from two symmetry-related 1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole ligands and two O atoms from two monodeprotonated 2,4,5-tricarboxybenzoate anions in equatorial positions and by two water O atoms in axial positions, leading to a distorted octahedral environment. In the crystal, complex molecules and solvent water molecules are linked through intermolecular O—H...O, O—H...N and N—H...O hydrogen bonds into a three-dimensional network. Intramolecular O—H...O hydrogen bonds are also present.
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spelling doaj.art-3be3b17a483442cd803baa176ee3285d2022-12-21T19:42:18ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-02-01682m139m14010.1107/S1600536812000384Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrateLei ZhaoBingtao LiuGuanghua JinXiangru MengIn the title complex, [Cd(C10H5O8)2(C10H9N5)2(H2O)2]·2H2O, the CdII ion lies on an inversion center and is coordinated by two N atoms from two symmetry-related 1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole ligands and two O atoms from two monodeprotonated 2,4,5-tricarboxybenzoate anions in equatorial positions and by two water O atoms in axial positions, leading to a distorted octahedral environment. In the crystal, complex molecules and solvent water molecules are linked through intermolecular O—H...O, O—H...N and N—H...O hydrogen bonds into a three-dimensional network. Intramolecular O—H...O hydrogen bonds are also present.http://scripts.iucr.org/cgi-bin/paper?S1600536812000384
spellingShingle Lei Zhao
Bingtao Liu
Guanghua Jin
Xiangru Meng
Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
Acta Crystallographica Section E
title Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
title_full Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
title_fullStr Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
title_full_unstemmed Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
title_short Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-κN4}bis(2,4,5-tricarboxybenzoato-κO1)cadmium dihydrate
title_sort diaquabis 1 1h benzimidazol 2 yl methyl 1h 1 2 4 triazole amp 954 n4 bis 2 4 5 tricarboxybenzoato amp 954 o1 cadmium dihydrate
url http://scripts.iucr.org/cgi-bin/paper?S1600536812000384
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AT bingtaoliu diaquabis11hbenzimidazol2ylmethyl1h124triazoleamp954n4bis245tricarboxybenzoatoamp954o1cadmiumdihydrate
AT guanghuajin diaquabis11hbenzimidazol2ylmethyl1h124triazoleamp954n4bis245tricarboxybenzoatoamp954o1cadmiumdihydrate
AT xiangrumeng diaquabis11hbenzimidazol2ylmethyl1h124triazoleamp954n4bis245tricarboxybenzoatoamp954o1cadmiumdihydrate