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首页> 外文期刊>Structural Chemistry >(pi)C-H center dot center dot center dot S, (allyl)C-H center dot center dot center dot C(pi) and pi center dot center dot center dot pi intermolecular interactions: synthesis, characterization, and crystal structure of 2,2'-bipyridine bis(diallyldit
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(pi)C-H center dot center dot center dot S, (allyl)C-H center dot center dot center dot C(pi) and pi center dot center dot center dot pi intermolecular interactions: synthesis, characterization, and crystal structure of 2,2'-bipyridine bis(diallyldit

机译:(pi)CH中心点中心点中心点S,(烯丙基)CH中心点中心点中心点C(pi)和pi中心点中心点中心点pi的分子间相互作用:2,2'的合成,表征和晶体结构-联吡啶二(二烯丙基

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摘要

A mixed-ligand Zn(II) complex formulated as [Zn(aldtc)(2)(bipy)] (aldtc=diallyldithiocarbamate; bipy=2,2 '-bipyridine) was synthesized and characterized by IR, H-1 and C-13 NMR spectral measurements and X-ray crystallography. The crystal structure of this complex indicates that Zn has a distorted octahedral geometry. The Zn-N distances are invariant (2.168(2) angstrom), while those of the Zn-S are slightly different (2.5408(9) and 2.5440(9) angstrom). The N-Zn-N, S-Zn-S and N-Zn-S bond angles are in the range 75.35(13)-99.75(7)degrees, 70.48(3)-161.02(5)degrees and 95.26(7)-160.32(7)degrees, respectively. The crystal packing of the complex shows different motifs of supramolecularity resulting from both hydrophilic ((pi)C-(HS)-S-...) and hydrophobic ((allyl)C-(HC)-C-...(pi)) intermolecular interactions. These interactions result in a chain arrangement of molecules along crystallographic c axis and the chains are further connected via pi(...)pi stacking along with ((pi)C-(HS)-S-... along b axis leading to an overall crystal packing that can be regarded as layers of complexes along bc plane, which are held together through nonconventional hydrogen bonding and pi(...)pi stacking.
机译:合成了配体为[Zn(aldtc)(2)(bipy)]的混合配体Zn(II)络合物(aldtc =二烯丙基二硫代氨基甲酸酯; bipy = 2,2'-联吡啶),并通过IR,H-1和C-进行了表征13 NMR光谱测量和X射线晶体学。该络合物的晶体结构表明Zn具有扭曲的八面体几何形状。 Zn-N距离不变(2.168(2)埃),而Zn-S的距离略有不同(2.5408(9)和2.5440(9)埃)。 N-Zn-N,S-Zn-S和N-Zn-S键角在75.35(13)-99.75(7)度,70.48(3)-161.02(5)度和95.26(7)范围内-160.32(7)度。配合物的晶体堆积显示出亲水性(πC-(HS)-S -...)和疏水性((烯丙基)C-(HC)-C -...(pi ))的分子间相互作用。这些相互作用导致分子沿晶体c轴的链排列,并且这些链进一步通过pi(...)pi堆积以及((pi)C-(HS)-S -...)沿b轴连接,从而导致整个晶体堆积,可以看作是沿bc平面的复合物层,通过非常规氢键和pi(...)pi堆叠将其保持在一起。

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