聚[[tetra-aqua(μ3-4-hy-droxy-pyridine-2, 6-di-carboxyl-ato) di -μ2-oxalato-dipraseodymium (III)] 4.29水合物]。

IUCrData Pub Date : 2025-05-30 eCollection Date: 2025-05-01 DOI:10.1107/S2414314625004560
Aaqib Khurshid, Apinpus Rujiwatra, Thammanoon Chuasaard
{"title":"聚[[tetra-aqua(μ3-4-hy-droxy-pyridine-2, 6-di-carboxyl-ato) di -μ2-oxalato-dipraseodymium (III)] 4.29水合物]。","authors":"Aaqib Khurshid, Apinpus Rujiwatra, Thammanoon Chuasaard","doi":"10.1107/S2414314625004560","DOIUrl":null,"url":null,"abstract":"<p><p>The coordination polymer of crystal formula [Pr<sup>III</sup> <sub>2</sub>(C<sub>7</sub>H<sub>2</sub>NO<sub>5</sub>)(C<sub>2</sub>O<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>O)<sub>4</sub>]·4.29H<sub>2</sub>O or [Pr<sup>III</sup> <sub>2</sub>(HCAM)(ox)<sub>2</sub>(H<sub>2</sub>O)<sub>4</sub>]·4.29H<sub>2</sub>O was synthesized from praseodymium(III) nitrate in water using chelidamic acid (H<sub>3</sub>CAM) and oxalic acid (H<sub>2</sub>ox). There are two Pr<sup>III</sup> atoms in the asymmetric unit. One metal ion has nine-fold coordination from one pyridyl nitro-gen and eight oxygen atoms from one HCAM<sup>2-</sup>, two ox<sup>2-</sup>, and two coordinating water mol-ecules leading to the formation of a tricapped trigonal {Pr<sup>III</sup>NO<sub>8</sub>} prism. The other metal ion is coordinated by ten oxygen atoms from two HCAM<sup>2-</sup>, two ox<sup>2-</sup>, and two coordinating water mol-ecules, forming a bicapped square {Pr<sup>III</sup>O<sub>10</sub>} unit. The HCAM<sup>2-</sup> linker has a μ<sub>2</sub>-κ<sup>2</sup>:κ<sup>1</sup> chelating coordination mode <i>via</i> its carboxyl-ates and N-pyridyl donors, linking the {Pr<sup>III</sup>NO<sub>8</sub>} and {Pr<sup>III</sup>O<sub>10</sub>} units into infinite chains. The μ<sub>2</sub>-κ<sup>1</sup>:κ<sup>1</sup>:κ<sup>1</sup>:κ<sup>1</sup> bridging carboxyl-ates of the ox<sup>2-</sup> linkers connect adjacent chains into sheets in the <i>ac</i> plane. Adjacent layers further aggregate through inter-molecular hydrogen bonding, most of which involves the water mol-ecules of crystallization, and π-π inter-actions to form a tri-periodic supra-molecular framework. Some of the co-crystallizing water mol-ecules as well as one of the metal-coordinating water mol-ecules are disordered.</p>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"10 Pt 5","pages":"x250456"},"PeriodicalIF":0.0000,"publicationDate":"2025-05-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC12142396/pdf/","citationCount":"0","resultStr":"{\"title\":\"Poly[[tetra-aqua-(μ<sub>3</sub>-4-hy-droxy-pyridine-2,6-di-carboxyl-ato)di-μ<sub>2</sub>-oxalato-dipraseodymium(III)] 4.29-hydrate].\",\"authors\":\"Aaqib Khurshid, Apinpus Rujiwatra, Thammanoon Chuasaard\",\"doi\":\"10.1107/S2414314625004560\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p><p>The coordination polymer of crystal formula [Pr<sup>III</sup> <sub>2</sub>(C<sub>7</sub>H<sub>2</sub>NO<sub>5</sub>)(C<sub>2</sub>O<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>O)<sub>4</sub>]·4.29H<sub>2</sub>O or [Pr<sup>III</sup> <sub>2</sub>(HCAM)(ox)<sub>2</sub>(H<sub>2</sub>O)<sub>4</sub>]·4.29H<sub>2</sub>O was synthesized from praseodymium(III) nitrate in water using chelidamic acid (H<sub>3</sub>CAM) and oxalic acid (H<sub>2</sub>ox). There are two Pr<sup>III</sup> atoms in the asymmetric unit. One metal ion has nine-fold coordination from one pyridyl nitro-gen and eight oxygen atoms from one HCAM<sup>2-</sup>, two ox<sup>2-</sup>, and two coordinating water mol-ecules leading to the formation of a tricapped trigonal {Pr<sup>III</sup>NO<sub>8</sub>} prism. The other metal ion is coordinated by ten oxygen atoms from two HCAM<sup>2-</sup>, two ox<sup>2-</sup>, and two coordinating water mol-ecules, forming a bicapped square {Pr<sup>III</sup>O<sub>10</sub>} unit. The HCAM<sup>2-</sup> linker has a μ<sub>2</sub>-κ<sup>2</sup>:κ<sup>1</sup> chelating coordination mode <i>via</i> its carboxyl-ates and N-pyridyl donors, linking the {Pr<sup>III</sup>NO<sub>8</sub>} and {Pr<sup>III</sup>O<sub>10</sub>} units into infinite chains. The μ<sub>2</sub>-κ<sup>1</sup>:κ<sup>1</sup>:κ<sup>1</sup>:κ<sup>1</sup> bridging carboxyl-ates of the ox<sup>2-</sup> linkers connect adjacent chains into sheets in the <i>ac</i> plane. Adjacent layers further aggregate through inter-molecular hydrogen bonding, most of which involves the water mol-ecules of crystallization, and π-π inter-actions to form a tri-periodic supra-molecular framework. Some of the co-crystallizing water mol-ecules as well as one of the metal-coordinating water mol-ecules are disordered.</p>\",\"PeriodicalId\":94324,\"journal\":{\"name\":\"IUCrData\",\"volume\":\"10 Pt 5\",\"pages\":\"x250456\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2025-05-30\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC12142396/pdf/\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"IUCrData\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1107/S2414314625004560\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"2025/5/1 0:00:00\",\"PubModel\":\"eCollection\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"IUCrData","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1107/S2414314625004560","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2025/5/1 0:00:00","PubModel":"eCollection","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0

摘要

以螯合酸(H3CAM)和草酸(H2ox)为原料,在水中合成了晶式为[PrIII 2(C7H2NO5)(C2O4)2(H2O)4]·4.29H2O或[PrIII 2(HCAM)(ox)2(H2O)4]·4.29H2O的配位聚合物。不对称单元中有两个PrIII原子。一个金属离子与一个吡啶基氮有9倍配位,与一个HCAM2-、两个ox2-和两个配位的水分子有8个氧原子配位,从而形成一个三角三角{PrIIINO8}棱镜。另一个金属离子由来自两个HCAM2-、两个ox2-和两个配位水分子的十个氧原子配位,形成一个双截方形{PrIIIO10}单元。HCAM2-连接体通过羧酸盐和n -吡啶基给体形成μ2-κ2:κ1螯合配位模式,将{PrIIINO8}和{PrIIIO10}连接成无限链。ox2-连接体的μ2-κ1:κ1:κ1:κ1桥接羧酸盐在ac平面上将相邻链连接成薄片。相邻层通过分子间氢键进一步聚集,其中大部分涉及水分子的结晶和π-π相互作用,形成三周期超分子框架。一些共结晶水分子和一个金属配位水分子是无序的。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Poly[[tetra-aqua-(μ3-4-hy-droxy-pyridine-2,6-di-carboxyl-ato)di-μ2-oxalato-dipraseodymium(III)] 4.29-hydrate].

The coordination polymer of crystal formula [PrIII 2(C7H2NO5)(C2O4)2(H2O)4]·4.29H2O or [PrIII 2(HCAM)(ox)2(H2O)4]·4.29H2O was synthesized from praseodymium(III) nitrate in water using chelidamic acid (H3CAM) and oxalic acid (H2ox). There are two PrIII atoms in the asymmetric unit. One metal ion has nine-fold coordination from one pyridyl nitro-gen and eight oxygen atoms from one HCAM2-, two ox2-, and two coordinating water mol-ecules leading to the formation of a tricapped trigonal {PrIIINO8} prism. The other metal ion is coordinated by ten oxygen atoms from two HCAM2-, two ox2-, and two coordinating water mol-ecules, forming a bicapped square {PrIIIO10} unit. The HCAM2- linker has a μ221 chelating coordination mode via its carboxyl-ates and N-pyridyl donors, linking the {PrIIINO8} and {PrIIIO10} units into infinite chains. The μ21111 bridging carboxyl-ates of the ox2- linkers connect adjacent chains into sheets in the ac plane. Adjacent layers further aggregate through inter-molecular hydrogen bonding, most of which involves the water mol-ecules of crystallization, and π-π inter-actions to form a tri-periodic supra-molecular framework. Some of the co-crystallizing water mol-ecules as well as one of the metal-coordinating water mol-ecules are disordered.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
CiteScore
0.30
自引率
0.00%
发文量
0
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:604180095
Book学术官方微信