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Supramolecular Complexation of N-Alkyl- and N,N '-Dialkylpiperazines with Cucurbit[6]uril in Aqueous Solution and in the Solid State

机译:N-烷基和N,N'-二烷基哌嗪与葫芦[6]尿素在水溶液和固态中的超分子络合

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摘要

Complex stoichiometry/composition and degree of oligomerization (oligomeric supramolecular complex formation) of cucurbit[6]uril (CB[6]) with N-alkyl- and N,N'-dialkylpiperazine were investigated in aqueous solutions by means of isothermal titration calorimetry (ITC), ESI-MS, NMR and light scattering measurements. It was found that the complex stability and the degree of oligomerization increase with elongating the alkyl chain attached to the piperazine core. X-ray crystallographic studies revealed a clear correlation between the structure of CB[6]-alkylpiperazine crystals obtained from aqueous solutions and the molecular weight/properties of host-guest oligomers existed in the solution as supramolecular "seeds" of crystal formation.
机译:用等温滴定量热法研究了葫芦[6]尿素(CB [6])与N-烷基和N,N'-二烷基哌嗪的配合物化学计量/组成和低聚度(低聚超分子复合物的形成) ITC),ESI-MS,NMR和光散射测量。已经发现,复杂性和低聚度随着延伸连接至哌嗪核心的烷基链而增加。 X射线晶体学研究表明,从水溶液中获得的CB [6]-烷基哌嗪晶体的结构与溶液中作为晶体形成的超分子“种子”存在的主体-客体低聚物的分子量/性质之间存在明显的相关性。

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