A. E. Toshtemirov, Kh. Kh. Turaev, I. A. Umbarov, N. A. Ermuratova, K. N. Kornilov
{"title":"在曼德酸存在下1,10-菲罗啉和硝酸阴离子铜配合物的合成及其晶体结构","authors":"A. E. Toshtemirov, Kh. Kh. Turaev, I. A. Umbarov, N. A. Ermuratova, K. N. Kornilov","doi":"10.1134/S1063774524602065","DOIUrl":null,"url":null,"abstract":"<p>The synthesis of a complex compound based on divalent copper as a complexing agent and 1,10-phenanthroline and nitrate ion as ligands has been described for the first time. The obtained complex, being linked with mandelic acid by hydrogen bonds, associates it in the external sphere. The interest in these ligands is caused by their potential biological activity and possibility of using them in pharmaceutics. The composition of the synthesized metal complex is found to be [Cu(1,10-<i>phen</i>)<sub>2</sub>NO<sub>3</sub>](C<sub>8</sub>H<sub>8</sub>O<sub>3</sub>⋅NO<sub>3</sub>), as confirmed by elemental analysis. The molecular and crystal structures of the complex are studied by X-ray diffraction (XRD). Its crystallographic characteristics, bond angles, lattice parameters, and geometry of hydrogen bonds are determined. The data obtained made it possible to construct a 3D model of the material. A Hirshfeld surface analysis of the metal complex, performed using the Crystal Explorer program, showed the presence of hydrogen bonds in it, which stabilize its crystal structure.</p>","PeriodicalId":527,"journal":{"name":"Crystallography Reports","volume":"69 7","pages":"1087 - 1092"},"PeriodicalIF":0.6000,"publicationDate":"2025-02-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Synthesis of Copper(II) Complex with 1,10-Phenanthroline and Nitrate Anion in the Presence of Mandelic Acid and the Crystalline Structure of This Complex\",\"authors\":\"A. E. Toshtemirov, Kh. Kh. Turaev, I. A. Umbarov, N. A. Ermuratova, K. N. Kornilov\",\"doi\":\"10.1134/S1063774524602065\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p>The synthesis of a complex compound based on divalent copper as a complexing agent and 1,10-phenanthroline and nitrate ion as ligands has been described for the first time. The obtained complex, being linked with mandelic acid by hydrogen bonds, associates it in the external sphere. The interest in these ligands is caused by their potential biological activity and possibility of using them in pharmaceutics. The composition of the synthesized metal complex is found to be [Cu(1,10-<i>phen</i>)<sub>2</sub>NO<sub>3</sub>](C<sub>8</sub>H<sub>8</sub>O<sub>3</sub>⋅NO<sub>3</sub>), as confirmed by elemental analysis. The molecular and crystal structures of the complex are studied by X-ray diffraction (XRD). Its crystallographic characteristics, bond angles, lattice parameters, and geometry of hydrogen bonds are determined. The data obtained made it possible to construct a 3D model of the material. A Hirshfeld surface analysis of the metal complex, performed using the Crystal Explorer program, showed the presence of hydrogen bonds in it, which stabilize its crystal structure.</p>\",\"PeriodicalId\":527,\"journal\":{\"name\":\"Crystallography Reports\",\"volume\":\"69 7\",\"pages\":\"1087 - 1092\"},\"PeriodicalIF\":0.6000,\"publicationDate\":\"2025-02-16\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Crystallography Reports\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://link.springer.com/article/10.1134/S1063774524602065\",\"RegionNum\":4,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q4\",\"JCRName\":\"CRYSTALLOGRAPHY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Crystallography Reports","FirstCategoryId":"88","ListUrlMain":"https://link.springer.com/article/10.1134/S1063774524602065","RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CRYSTALLOGRAPHY","Score":null,"Total":0}
Synthesis of Copper(II) Complex with 1,10-Phenanthroline and Nitrate Anion in the Presence of Mandelic Acid and the Crystalline Structure of This Complex
The synthesis of a complex compound based on divalent copper as a complexing agent and 1,10-phenanthroline and nitrate ion as ligands has been described for the first time. The obtained complex, being linked with mandelic acid by hydrogen bonds, associates it in the external sphere. The interest in these ligands is caused by their potential biological activity and possibility of using them in pharmaceutics. The composition of the synthesized metal complex is found to be [Cu(1,10-phen)2NO3](C8H8O3⋅NO3), as confirmed by elemental analysis. The molecular and crystal structures of the complex are studied by X-ray diffraction (XRD). Its crystallographic characteristics, bond angles, lattice parameters, and geometry of hydrogen bonds are determined. The data obtained made it possible to construct a 3D model of the material. A Hirshfeld surface analysis of the metal complex, performed using the Crystal Explorer program, showed the presence of hydrogen bonds in it, which stabilize its crystal structure.
期刊介绍：
Crystallography Reports is a journal that publishes original articles short communications, and reviews on various aspects of crystallography: diffraction and scattering of X-rays, electrons, and neutrons, determination of crystal structure of inorganic and organic substances, including proteins and other biological substances; UV-VIS and IR spectroscopy; growth, imperfect structure and physical properties of crystals; thin films, liquid crystals, nanomaterials, partially disordered systems, and the methods of studies.
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