[Mn(N,N'-bis(salicylidene)phenylenediamine)(7-methoxy-7,7,8,8-tetra-cyano-p-quinodimethane)]*(acetonitrile) | 1166403-94-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [Mn(N,N'-bis(salicylidene)phenylenediamine)(7-methoxy-7,7,8,8-tetra-cyano-p-quinodimethane)]*(acetonitrile)
• 英文别名: [Mn(salophen)(MeOTCNQ)]*(acetonitrile)
• CAS: 1166403-94-6
• 化学式: C₂H₃N*C₁₃H₇N₄O*C₂₀H₁₄N₂O₂*Mn
• 分子量: 645.559
• InChiKey: IPUHWPNGYGBDDM-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  5.33
• 重原子数：
  46.0
• 可旋转键数：
  6.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  199.02
• 氢给体数：
  0.0
• 氢受体数：
  10.0

反应信息

• 作为产物：
  描述：

  甲醇 、 manganese(II) perchlorate hexahydrate 、 N,N'-二水杨醛缩-1,2-苯二胺 、 lithium 7,7,8,8-tetracyanoquinodimethane 、 乙腈 以 乙腈 为溶剂， 以65%的产率得到[Mn(N,N'-bis(salicylidene)phenylenediamine)(7-methoxy-7,7,8,8-tetra-cyano-p-quinodimethane)]*(acetonitrile)
  参考文献：
  名称：

  Synthesis, crystal structure and magnetic properties of a one-dimensional Mn(III) Schiff-base complex bridged by derivative of tetracyano-p-quinodimethane

  摘要：

  A new one-dimensional manganese(III) Schiff-base complex [Mn(III)(salophen) (MeOTCNQ)] center dot CH3CN 1 (salophen = N, N'-bis(salicylidene) phenylenediamine) bridged by 7-methoxy-7,7,8,8-tetra-cyano-p-quinodimethane (MeOTCNQ), has been synthesized and characterized by X-ray crystallography and magnetic studies. Crystal structure study reveals that complex 1 has a 1D manganese(III) chain bridged by MeOTCNQ ligand which was obtained unexpectedly from tetracyano-p-quinodimethane (TCNQ) reacting with methanol. Noticeably, MeOTCNQ molecules in complex 1 adopt an unusual cis-syn coordination mode. The analysis of magnetic data indicates that a weak intrachain antiferromagnetic interaction exists in complex 1. (C) 2009 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2009.03.012