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首页> 外文期刊>Journal of Chemical Sciences >Weak C-H…F-C interactions in carboxylate anion binding: Synthesis, spectroscopic and X-ray structural studies of [Co(phen)2CO3]2 (C7H3O2FCl)Cl·11H2O and [Co(phen)2CO3](C7H3NO4Cl)·6H2O
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Weak C-H…F-C interactions in carboxylate anion binding: Synthesis, spectroscopic and X-ray structural studies of [Co(phen)2CO3]2 (C7H3O2FCl)Cl·11H2O and [Co(phen)2CO3](C7H3NO4Cl)·6H2O

机译:弱的CH…FC相互作用与羧酸根阴离子的结合:[Co(phen) 2 CO 3 ] 2 (C 7 H 3 O 2 FC1)Cl·11H 2 O和[Co(phen)< sub> 2 CO 3 ](C 7 H 3 NO 4 Cl)·6H < sub> 2 O

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摘要

Two new complex salts containing 2,5-substituted benzoate ions, [Co(phen)2CO3]2(C7H3O2FCl)Cl·11H2O (1) and [Co(phen)2CO3](C7H3NO4Cl)·6H2O (2) (where phen = 1,10-phenanthroline, C7H3O2FCl = 2-chloro-5-fluorobenzoate (cfbz) and C7H3NO4Cl = 2-chloro-5-nitrobenzoate(cnbz)) were synthesized by reacting carbonatobis(1,10-phenanthroline)cobalt(III) chloride with appropriate salts in aqueous medium. A detailed packing analysis has been undertaken to delineate the role of second sphere C-H…F and C-H…O interactions amid other heteroatom interactions. The complex salts have been characterized by elemental analyses, spectroscopic studies (IR, UV/Visible, multinuclear NMR), conductance and solubility product measurements. Single crystal X-ray structure determination revealed ionic structures of both the complex salts having discrete ions along with lattice water molecules. Crystal lattice is stabilized by a variety of hydrogen bonding interactions, i.e. O-H…O, C-H…O and C-H…F involving second sphere coordination besides π-π interaction. Furthermore, packing analyses reveal that C-H…F interactions can manifest even in the presence of a large number of heteroatom interactions.
机译:含有2,5-取代的苯甲酸盐离子的两种新的络盐[Co(phen) 2 CO 3 ] 2 (C 7 H 3 O 2 FC1)Cl·11H 2 O(1)和[Co(phen) 2 < / sub> CO 3 ](C 7 H 3 NO 4 Cl)·6H 2 < / sub> O(2)(其中phen = 1,10-菲咯啉,C 7 H 3 O 2 FC1 = 2-氯-合成了5-氟苯甲酸酯(cfbz)和C 7 H 3 NO 4 Cl = 2-氯-5-硝基苯甲酸酯(cnbz))在水性介质中使碳酰双(1,10-菲咯啉)氯化钴(III)与适当的盐反应。已经进行了详细的堆积分析,以描述第二球C-H…F和C-H…O在其他杂原子相互作用中的相互作用。通过元素分析,光谱研究(IR,UV / Visible,多核NMR),电导和溶解度产物测量来表征复合盐。单晶X射线结构测定揭示了具有离散离子的两种配盐以及晶格水分子的离子结构。晶格通过各种氢键相互作用(即除π-π相互作用外还涉及第二球配位的O-H…O,C-H…O和C-H…F)稳定化。此外,堆积分析表明,即使存在大量杂原子相互作用,C-H … F相互作用也可以表现出来。

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