[Ni(N,N'-ethylenebis(3-ethoxysalicylaldimine)(-2H))]*water | 55304-38-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: [Ni(N,N'-ethylenebis(3-ethoxysalicylaldimine)(-2H))]*water
• 英文别名: [Ni(N,N'-ethylenebis(3-ethoxysalicylaldiimine(-2H))]*H2O
• CAS: 55304-38-6
• 化学式: C₂₀H₂₂N₂NiO₄*H₂O
• 分子量: 431.111
• InChiKey: IIPDMDWVNVOSCY-FDOBHKDXSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  丁二酸 、 [Ni(N,N'-ethylenebis(3-ethoxysalicylaldimine)(-2H))]*water 以 丙酮 为溶剂， 以62%的产率得到
  参考文献：
  名称：

  Exploration of weak interaction directed self-assemblies on reacting mononuclear copper(II)/nickel(II)⋯water host⋯guest systems of a double-compartment ligand with mono/di/tricarboxylic acids

  摘要：

  The work in this report deals with the syntheses, characterization, molecular and supramolecular structures of eight compounds of the composition [{(CuLOEt-en)-L-II subset of(H3O)}(o-chlorobenzoate)] (1), [{(CuLOEt-en)-L-II subset of(H2O)}(2)(fumaric acid)] (2), [{(NiLOEt-en)-L-II subset of(H2O)}(2)(fumaric acid)] (3), [{(CuLOEt-en)-L-II subset of(H2O)}(2)(succinic acid)] (4), [{(NiLOEt-en)-L-II subset of(H2O)}(2)(succinic acid)] (5), [{(NiLOEt-en)-L-II subset of(H2O)}(2)(terephthalic acid)] (6), [{(CuLOEt-en)-L-II subset of (H2O)}(1,3,5-benzenetricarboxylic acid)]center dot MeOH (7) and [{(NiLOEt-en)-L-II subset of(H2O)}(1,3,5-benzenetricarboxylic acid)]center dot MeOH (8), where H2LOEt-en is N,N'-ethylenebis(3-ethoxysalicylaldimine). These compounds are obtained on reacting the mononuclear host-guest compound [(CuLOEt-en)-L-II subset of(H2O)]/[(NiLOEt-en)-L-II subset of(H2O)], which contains a trapped water molecule, with the corresponding mono/di/tricarboxylic acid. One water molecule in 2-8 and one oxonium ion in 1 is trapped in each O(phenoxo)(2)O(ethoxy)(2) compartment. Both the carboxylic acid groups of the dicarboxylic acids are involved in interacting with the trapped water molecule, forming the supramolecular dimers 2-6, while one of the three carboxylic acid groups of 1,3,5-benzenetricarboxylic acid is involved in O-H center dot center dot center dot O(trapped water) hydrogen bond, forming the 1:1 adducts 7 and 8. Compound 1 contains o-chlorobenzoate and the trapped species herein is the oxonium ion (H3O+). [{(CuLOEt-en)-L-II subset of(H3O)](+) and o-chlorobenzoate fragments in 1 are self-assembled because of an O-H(oxonium ion)center dot center dot center dot O(carboxylate) hydrogen bond. The above mentioned adducts are further self-assembled to generate 1-D/2-D/3-D supramolecular structures because of hydrogen bonds/pi center dot center dot center dot pi interactions/Ni-II center dot center dot center dot Ni-II interactions/halogen bonds. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2015.04.033
• 作为产物：
  描述：

  水 、 nickel(II) acetate tetrahydrate 、 N,N'-bis(3-ethoxy-2-hydroxybenzylidene)ethylenediamine 以 甲醇 、 水 为溶剂， 以85%的产率得到[Ni(N,N'-ethylenebis(3-ethoxysalicylaldimine)(-2H))]*water
  参考文献：
  名称：

  单核 NiIII 夹杂产物和自组装 [2 × 1+1 × 2] NiIII3MII(M = Cu、Ni、Co、Fe 或 Mn) 共晶的合成、晶体结构和质谱分析 N,N'-亚乙基双 (3-乙氧基水杨醛亚胺) )

  摘要：

  单核镍(II)化合物[Ni II L 1 ⊂(H 2 O)] (1)和[2 × 1+1 × 2]共晶[{Ni II L 1 M II (H 2 O) 3 }{Ni II L 1 } 2 ](ClO 4 ) 2 [M = Cu (2), Ni (3), Co (4), Fe (5) 和 Mn (6)] 衍生自六齿席夫碱区室配体 N,N'-亚乙基双(3-乙氧基水杨醛亚胺) (H 2 L 1 ) 在该研究中已有描述。化合物 1 是一种包合物，其中水分子通过形成分叉氢键被包裹在 O 4 隔室中。1 与铜 (II)、镍 (II)、钴 (II)、铁 (II) 和锰 (II) 的高氯酸盐在开放气氛中反应生成具有相似结构的化合物 2-6。这些化合物是 [2 × 1+1 × 2] 四金属系统，包含自组装和共结晶的一个双核 [Ni II L 1 M II (H 2 O) 3 ] 2+ 阳离子和两个单核 [Ni

  DOI：

  10.1002/ejic.200900685

文献信息

• Design of weak interaction directed self-assemblies of nickel(II) complexes using diprotonated diamines as supramolecular tectons: Syntheses and crystal structures
  作者：Sohini Sarkar、Michel Fleck、Sasankasekhar Mohanta

  DOI：10.1016/j.molstruc.2012.04.025

  日期：2012.8

  this paper reports syntheses, characterization and crystal structures of three designed host–guest compounds [(NiIIL)2 ⊂ (H3NCH2CH2NH3)](NO3)2 (1), [(NiIIL)2 ⊂ (H3NCH2CH2CH2NH3)](NO3)2 (2) and [(NiIIL)2 ⊂ (H3NCH2CH2CH2CH2NH3)](NO3)2 (3), where H2L is the compartmental Schiff base ligand N,N′-ethylenebis(3-ethoxysalicylaldimine). All three crystals are triclinic, compounds 1 and 3 are centrosymmetric

  摘要 本文的工作报告了三种设计的主客体化合物 [(NiIIL)2 ⊂ (H3N NH3)](NO3)2 (1)、[(NiIIL)2 ⊂ (H3N NH3)]( )2 (2) 和 [(NiIIL)2 ⊂ (H3N NH3)]( )2 (3)，其中 H2L 是隔室希夫碱配体 N,N'-亚乙基双（3-乙氧基水杨醛亚胺）。所有三种晶体都是三斜晶系，化合物 1 和 3 是中心对称的（空间群 P 1 ¯ ），而化合物 2 不是（空间群 P1）。在所有这三种化合物 1-3 中，[H3N(CH2)nNH3]2+ 阳离子 (n = 2-4) 的两个 +NH3 位点通过氢键充当两个 [NiIIL] 部分的 O4 隔室中的客体涉及 +NH3 位点的两个氢原子以及 O4 隔室的两个苯氧基和两个乙氧基氧原子。因此，双质子化二胺作为构造体将两个单核镍 (II)
• Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged M^IILn^III Complexes Derived from <i>N</i>,<i>N</i>‘-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce−Yb):  Observation of Surprisingly Strong Exchange Interactions
  作者：Rajesh Koner、Hsin-Huang Lin、Ho-Hsiang Wei、Sasankasekhar Mohanta

  DOI：10.1021/ic048196h

  日期：2005.5.1

  A series of heterodinuclear Cu(II)Ln(III) and Ni(II)Ln(III) complexes, [M(II)L(1)Ln(III)(NO(3))(3)] (M = Cu or Ni; Ln = Ce-Yb), with the hexadentate Schiff base compartmental ligand N,N'-ethylenebis(3-ethoxysalicylaldiimine) (H(2)L(1)) have been synthesized and characterized. The X-ray crystal structure determinations of 13 of these compounds reveal that they are all isostructural. All of these complexes

  一系列异双核Cu（II）Ln（III）和Ni（II）Ln（III）配合物[M（II）L（1）Ln（III）（NO（3））（3）]（M = Cu或Ni； Ln = Ce-Yb），具有六齿Schiff碱区室配体N，N'-亚乙基双（3-乙氧基水杨基醛二胺）（H（2）L（1））已合成并表征。对这些化合物中的13种进行X射线晶体结构测定表明，它们都是同构结构。所有这些复合物均在具有近似相似晶胞参数的相同正交P2（1）2（1）2（1）空间群中结晶。通常情况下，该结构由双苯氧桥3d-4f双核核组成，由于分子间硝酸盐...铜（II）或硝酸盐...镍（II）半配位和弱CH ...而自组装成二维。 O氢键。尽管那样，相邻单元的金属中心间隔良好（最短分子间接触（A）的范围是（M ... M）7.46-7.60，（Ln ... Ln）8.56-8.69和（M ... Ln）6.12-6.20）。已对所有配合物进行了可变温度（5-300