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Crystal Structure and Thermal Property of 1-Ethyl Acetate Pyridinium Ionic Liquid

机译:1-乙酸乙基吡啶离子液体的晶体结构和热性能

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[EAPy][PF_6] Pyridinium ionic liquid was synthesized by two-step process: introduction of one ethyl acetate group and anions metathesis. Additionally, single crystals of the IL was first obtained by solvent-evaporation method in growth systems. [EAPy][PF_6] crystallizes in the monoclinic space group C2/c, with unit cell parameters a =22.748 A, b =6.204 A, c =18.552 A, β =92.66°, z =8,V=2615(3) A, Dc =1.58 Mg/m~3 and F(000)=1264. In its supramolecular structure, the double zigzag chains are formed by hydrogen bonds and these [P(1)F_6]~- and [P(2)F_6]~- anions are sandwiched respectively by pyridinium rings and ethyl acetate groups in the packing pattern. Moreover, [EAPy][PF_6] exhibits relatively high thermal stability and obvious supercooling during the cooling process, which makes pyridinium IL difficult to crystallize.
机译:[EAPY]通过两步法合成吡啶鎓离子液体:引入一种乙酸乙酯基团和阴离子复分解。另外,首先通过生长系统中的溶剂蒸发方法获得IL的单晶。 [EAPY] [PF_6]在单斜视组C2 / C中结晶,单位细胞参数A = 22.748A,B = 6.204a,C = 18.552A,β= 92.66°,Z = 8,V = 2615(3) A,DC = 1.58mg / m〜3和f(000)= 1264。在其超分子结构中,双锯齿链是通过氢键形成的,并且这些[P(1)F_6]〜 - 和[P(2)F_6]〜 - 阴离子分别通过包装图案中的吡啶环和乙酸乙酯基团夹在一起。此外,在冷却过程中,[EAPY] [PF_6]在冷却过程中表现出相对高的热稳定性和明显的过冷,这使得吡啶IL难以结晶。

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