首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >A one-dimensional polymeric cobalt(III)–potassium complex with 18-crown-6 cyanide and porphyrinate ligands
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A one-dimensional polymeric cobalt(III)–potassium complex with 18-crown-6 cyanide and porphyrinate ligands

机译:一维聚合物钴(III)-钾配合物具有18冠-6氰化物和卟啉配体

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摘要

The reaction of CoII(TpivPP) {TpivPP is the dianion of 5,10,15,20-tetra­kis­[2-(2,2-di­methyl­propanamido)­phen­yl]por­ph­yrin} with an excess of KCN salts and an excess of the 18-crown-6 in chloro­benzene leads to the polymeric title compound catena-poly[[dicyanido-2κ2 C-(1,4,7,10,13,16-hexa­oxa­cyclo­octa­decane-1κ6 O){μ3-(2α,2β)-5,10,15,20-tetra­kis­[2-(2,2-di­methyl­propanamido)­phen­yl]porphyrinato-1κO 5:2κ4 N,N′,N′′,N′′′:1′κO 15}cobalt(III)potassium] dihydrate], {[CoK(CN)2(C12H24O6)(C64H64N8O4]·2H2O}n. The CoIII ion lies on an inversion center, and the asymmetric unit contains one half of a [CoIII(2α,2β-TpivPP)(CN)2] ion complex and one half of a [K(18-C-6]+ counter-ion (18-C-6 is 1,4,7,10,13,16-hexa­oxa­cyclo­octa­deca­ne), where the KI ion lies on an inversion center. The CoIII ion is hexa­coordinated by two C-bonded axial cyanide ligands and the four pyrrole N atoms of the porphyrin ligand. The KI ion is chelated by the six O atoms of the 18-crown-6 mol­ecule and is further coordinated by two O atoms of pivalamido groups of the porphyrin ligands, leading to the formation of polymeric chains running along [011]. In the crystal, the polymeric chains and the lattice water mol­ecules are linked by N—H⋯O and O—H⋯N hydrogen bonds, as well as weak C—H⋯O, O—H⋯π and C—H⋯π inter­actions into a three-dimensional supra­molecular architecture.
机译:Co II (TpivPP){TpivPP是5,10,15,20-四[2-(2,2-二甲基丙酰胺基)苯基]卟啉的二价阴离子}与过量的KCN盐的反应而在氯苯中过量的18-crown-6会导致聚合物标题化合物catena-poly [[dicyanido-2κ 2 C-(1,4,7,10,13,16-hexaoxacyclooctadecane -1κ 6 O){μ3-(2α,2β)-5,10,15,20-四[2-(2,2-二甲基丙酰胺基)苯基]卟啉对-1κO 5 < / sup>:2κ 4 N,N',N'',N''':1'κO 15 }钴(III)钾]二水合物],{[ CoK(CN)2(C12H24O6)(C64H64N8O4]·2H2O} n。Co III 离子位于反转中心,不对称单元包含一半的[Co III (2α,2β-TpivPP)(CN)2] -离子络合物和[K(18-C-6] + 抗衡离子的一半( 18-C-6是1,4,7,10,13,16-六氧杂环十八烷),其中K I 离子位于一个反转中心。Co III 离子由两个C键合轴向氰化物配体六配位,并且卟啉配体的四个吡咯N原子。 K I 离子被18-crown-6分子的六个O原子螯合,并进一步与卟啉配体的新戊酰胺基的两个O原子配位,导致形成聚合链沿[011]。在晶体中,聚合物链和晶格水分子通过N-H⋯O和O-H⋯N氢键以及弱的C-H⋯O,OH-H⋯π和C-H⋯π连接相互作用成为三维超分子结构。

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