methylbis(2-[N(2)-(1,1,3,3-tetramethylguanidino)]ethyl)amine

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: methylbis(2-[N(2)-(1,1,3,3-tetramethylguanidino)]ethyl)amine
• 英文别名: N,N,N',N'-tetramethyl-N''-(2-{methyl-[2-(N',N',N'',N''-tetramethylguanidino)-ethyl]amino}ethyl)guanidine；2-[2-[2-[Bis(dimethylamino)methylideneamino]ethyl-methylamino]ethyl]-1,1,3,3-tetramethylguanidine；2-[2-[2-[bis(dimethylamino)methylideneamino]ethyl-methylamino]ethyl]-1,1,3,3-tetramethylguanidine
• 化学式: C₁₅H₃₅N₇
• 分子量: 313.49
• InChiKey: JZHSFBUUERRTJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.5
• 重原子数：
  22
• 可旋转键数：
  10
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  40.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  methylbis(2-[N(2)-(1,1,3,3-tetramethylguanidino)]ethyl)amine 以 not given 为溶剂， 生成 [Fe(((Me₂N)C=NC₂H₄)₂NMe)(OTf)₂]
  参考文献：
  名称：

  A More Reactive Trigonal-Bipyramidal High-Spin Oxoiron(IV) Complex with a cis-Labile Site

  摘要：

  The trigonal-bipyramidal high-spin (S = 2) oxoiron(IV) complex [Fe-IV(O)(TMG(2)dien)(CH3CN)](2+) (7) was synthesized and spectroscopically characterized. Substitution of the CH3CN ligand by anions, demonstrated here for X = N-3(-) and Cl-, yielded additional S = 2 oxoiron(IV) complexes of general formulation [Fe-IV(O)(TMG(2)dien)(X)](+) (7-X). The reduced steric bulk of 7 relative to the published S = 2 complex [FeIV(O)(TMG(3)tren)](2+) (2) was reflected by enhanced rates of intermolecular substrate oxidation.

  DOI：

  10.1021/ja2040909

文献信息

• Direct Resonance Raman Characterization of a Peroxynitrito Copper Complex Generated from O ₂ and NO and Mechanistic Insights into Metal‐Mediated Peroxynitrite Decomposition
  作者：Jeffrey J. Liu、Maxime A. Siegler、Kenneth D. Karlin、Pierre Moënne‐Loccoz

  DOI：10.1002/anie.201904672

  日期：2019.8.5

  We report the formation of a new copper peroxynitrite (PN) complex [CuII(TMG3tren)(κ1‐OONO)]+ (PN1) from the reaction of [CuII(TMG3tren)(O2.−)]+ (1) with NO.(g) at −125 °C. The first resonance Raman spectroscopic characterization of such a metal‐bound PN moiety supports a cis κ1‐(−OONO) geometry. PN1 transforms thermally into an isomeric form (PN2) with κ2‐O,O′‐(−OONO) coordination, which undergoes

  我们报告一个新的铜过氧（形成PN）络合物[铜II（TMG 3 TREN）（κ 1 -OONO）] +（PN1）从的反应物[Cu II（TMG 3 TREN）（O 2 .-） ] +（1）否。（g）在-125°C下。第一谐振这样的金属结合的拉曼光谱表征PN部分支持顺κ 1 - （- OONO）的几何形状。PN1热转变为异构体形式（PN2）与κ 2 -O，O' - （- OONO）协调，经过O-O键均裂生成推定cupryl（LCU其中II -O 。）中间体和NO 2 。。这些瞬时物种不重组，得到硝酸根（NO 3 - ）的产品，而是前进到效果的氧化化学和形成的Cu II -nitrito（NO 2 - ）配合物（2）。
• A More Reactive Trigonal-Bipyramidal High-Spin Oxoiron(IV) Complex with a cis-Labile Site
  作者：Jason England、Yisong Guo、Katherine M. Van Heuvelen、Matthew A. Cranswick、Gregory T. Rohde、Emile L. Bominaar、Eckard Münck、Lawrence Que

  DOI：10.1021/ja2040909

  日期：2011.8.10

  The trigonal-bipyramidal high-spin (S = 2) oxoiron(IV) complex [Fe-IV(O)(TMG(2)dien)(CH3CN)](2+) (7) was synthesized and spectroscopically characterized. Substitution of the CH3CN ligand by anions, demonstrated here for X = N-3(-) and Cl-, yielded additional S = 2 oxoiron(IV) complexes of general formulation [Fe-IV(O)(TMG(2)dien)(X)](+) (7-X). The reduced steric bulk of 7 relative to the published S = 2 complex [FeIV(O)(TMG(3)tren)](2+) (2) was reflected by enhanced rates of intermolecular substrate oxidation.