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Self-assembled supramolecular architecture with alternating porphyrin and phthalocyanine, bonded by hydrogen bonding and π-π stacking

机译:自组装的超分子结构,具有卟啉和酞菁交替,通过氢键和π-π堆积键合

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摘要

5,10, 15, 20-tetraphenyl porphyrinato manganese (III) (MnTPP) ligated by THF in opposite axial direc?tions and a sixcoordinate phthalocyaninato cobalt (II) (CoPc) with l-phenyl-lH-tetrazole-5-thiol (HL) molecules as axial ligands were self-assembled in a mixed solution of tetrahydrofuran and acetone (v/ v = 1:1) to form a hydrogen bonding "polymer" alternated with porphyrin (Por) and phthalocyanine (Pc) molecules, MnTPP(THF)_2CoPc(L)_2(1). The hydrogen bonding interaction was contributed by nitrogen [in the axial ligand (L~-) of phthalocyanine] and hydrogen atom (in a peripheral phenyl around the porphyrin ring). This hydrogen bonding "polymer" was also enhanced by π-π stacking of the tetrazole in L- with both TPP and Pc macrocycles. These polymer chains were constructed into their three-dimension (3D) architecture only by Van der Waal's attractions. Crystal data for 1 indicate a triclnic system of P-1 Unit cell: a = 11.3932(8) A, b = 12.6462(9) A, c = 14.4939(11) A, α = 91.1970(10)°, β = 95.5050(10)°, γ = 90.7200(10)°, and with cell volume of 2078.0(3) A~3.
机译:5,10,15,20-四苯基卟啉锰(III)(MnTPP)在相反的轴向方向上被THF和六配位酞菁钴(II)(CoPc)与1-苯基-1H-四唑-5-硫醇( HL)分子作为轴向配体在四氢呋喃和丙酮(v / v = 1:1)的混合溶液中自组装,形成与卟啉(Por)和酞菁(Pc)分子MnTPP( THF)_2CoPc(L)_2(1)。氢键相互作用是由氮[在酞菁的轴向配体(L〜-)中]和氢原子(在卟啉环周围的外围苯基中)引起的。氢键结合的“聚合物”也通过四唑在L-中与TPP和Pc大环的π-π堆积而得到增强。仅范德华(Van der Waal)的吸引力将这些聚合物链构建为三维(3D)结构。 1的晶体数据表示P-1晶胞的三斜晶系​​:a = 11.3932(8)A,b = 12.6462(9)A,c = 14.4939(11)A,α= 91.1970(10)°,β= 95.5050 (10)°,γ= 90.7200(10)°,池体积为2078.0(3)A〜3。

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