cis-[(tert-butyl)NP(OC6H4OMe-o)]2 | 862609-09-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: cis-[(tert-butyl)NP(OC6H4OMe-o)]2
• 英文别名: cis-[(o-MeOC6H4O)P(μ-Nt-Bu)]2；cis-[(o-MeOC6H4O)P(μ-NtBu)]2；cis-[t-BuNP(OC6H4OMe-o)]2
• CAS: 862609-09-4
• 化学式: C₂₂H₃₂N₂O₄P₂
• 分子量: 450.455
• InChiKey: VSCHQFGIQZWFCQ-RNPORBBMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.83
• 重原子数：
  30.0
• 可旋转键数：
  6.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  43.4
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  cis-[(tert-butyl)NP(OC6H4OMe-o)]2 、 copper(I) bromide 以 乙腈 为溶剂， 以79%的产率得到bis(1,3-di-tert-butyl-2,4-bis(2-methoxyphenoxy)-1,3,2l5,4-diazadiphosphetidin-2-yl)copper(III) bromide
  参考文献：
  名称：

  Copper(I) Coordination Polymers [{Cu(μ-X)}₂{RP(μ-N^tBu)}₂]_n (R = OC₆H₄OMe-o; X = Cl, Br, and I) and Their Reversible Conversion into Mononuclear Complexes [CuX{(RP(μ-N^tBu))₂}₂]:  Synthesis and Structural Characterization

  摘要：

  The reactions of cyclodiphosphazane cis-[(BuNP)-Bu-t(OC6H4OMe-o)](2) (1) with 2 equiv of CuX in acetonitrile afforded one-dimensional Cu-I coordination polymers [Cu2X2 {(BuNP)-Bu-t(OC6H4OMe-o)}(2)](n) (2, X) Cl; 3, X) Br; 4, X = 1). The crystal structures of 2 and 4 reveal a zigzag arrangement of [P(mu - N)(2)P] and [Cu(mu - X)(2)Cu] units in an alternating manner to form one- dimensional CuI coordination polymers. The reaction between 1 and CuX in a 2: 1 ratio afforded mononuclear tricoordinated copper(II) complexes of the type [CuX {((BuNP)-Bu-t(OC6H4OMe-o))(2)}(2)] (5, X) Cl; 6, X) Br; 7, X = I). The single-crystal structures were established for the mononuclear copper(I) complexes 5 and 6. When the reactant ratios are 1: 1, the formation of a mixture of polymeric and mononuclear products was observed. The CuI polymers (2 - 4) were converted into the mononuclear complexes ( 5 - 7) by reacting with 3 equiv of 1 in dimethyl sulfoxide. Similarly, the mononuclear complexes (5 - 7) were converted into the corresponding polymeric complexes (2 - 4) by reacting with 3 equiv of copper(I) halide under mild reaction conditions.

  DOI：

  10.1021/ic060464j

文献信息

• One-dimensional silver(<scp>i</scp>) coordination polymers containing cyclodiphosphazane, cis-{(o-MeOC₆H₄O)P(µ-N^tBu)}₂
  作者：P. Chandrasekaran、Joel T. Mague、Maravanji S. Balakrishna

  DOI：10.1039/b704303a

  日期：——

  The 1 : 1 reaction between the cyclodiphosphazane cis-(o-MeOC6H4O)P(µ-NtBu)}2 (1) and AgOTf afforded one-dimensional AgI coordination polymer [Agµ-OTf-κO,κO}µ-(o-MeOC6H4O)P(µ-NtBu)-κP,κP}2]∞ (2) containing bridging cyclodiphosphazane and trifluoromethanesulfonate (OTf) ligands. The 2 : 1 reaction of 1 and AgOTf leads to the formation of simple mononuclear complex [AgOTf-κO,κO}((o-MeOC6H4O)P(µ-NtBu)-κP}2)2] (3) in quantitative yield. Reaction of 1 with AgCN produces a strain-free zig-zag coordination polymer [((o-MeOC6H4O)P(µ-NtBu)-κP,κP}2)2Ag(NCAgCN)]∞ (4) irrespective of reaction stoichiometry and conditions. In complexes 3 and 4 cyclodiphosphazanes coordinate to AgI centers in a monodentate fashion. Single crystal structures were established for the AgI polymers 2 and 4.

  1 ：环二磷嗪顺式-(o-MeOC6H4O)P(µ-NtBu)}2 (1) 与 AgOTf 发生 1 : 1 反应，生成了一维 AgI 配位聚合物[Agµ-OTF-κO,κO}µ-(o-MeOC6H4O)P(µ-NtBu)-κP,κP}2]∞ (2)，其中含有桥接环二磷嗪和三氟甲磺酸盐 (OTf) 配体。1 与 AgOTf 的 2 : 1 反应可生成简单的单核复合物[AgOTF-κO,κO}((o-MeOC6H4O)P(µ-NtBu)-κP}2)2](3)，产量为定量。1 与 AgCN 反应生成无应变之字形配位聚合物[((o-MeOC6H4O)P(µ-NtBu)-κP,κP}2)2Ag(NCAgCN)]∞ (4)，与反应的化学计量和条件无关。在复合物 3 和 4 中，环二磷氮以单齿方式配位到 AgI 中心。AgI 聚合物 2 和 4 的单晶结构已经确定。
• Cyclodiphosphazanes with Hemilabile Ponytails:  Synthesis, Transition Metal Chemistry (Ru(II), Rh(I), Pd(II), Pt(II)), and Crystal and Molecular Structures of Mononuclear (Pd(II), Rh(I)) and Bi- and Tetranuclear Rhodium(I) Complexes
  作者：P. Chandrasekaran、Joel T. Mague、Maravanji S. Balakrishna

  DOI：10.1021/ic0509478

  日期：2005.10.1

  cis-[(t)()BuNP(OC(6)H(4)OMe-o)](2) (2), cis-[(t)()BuNP(OCH(2)CH(2)OMe)](2) (3), cis-[(t)BuNP(OCH(2)CH(2)SMe)](2) (4), and cis-[(t)BuNP(OCH(2)CH(2)NMe(2))](2) (5) were synthesized by reacting cis-[(t)()BuNPCl](2) (1) with corresponding nucleophiles. The reaction of 2 with [M(COD)Cl(2)] afforded cis-[MCl(2)(2)(2)] derivatives (M = Pd (6), Pt (7)), whereas, with [Pd(NCPh)(2)Cl(2)], trans-[MCl(2)(2)(2)] (8) was

  具有半不稳定马尾辫的环二磷氮烷，例如顺式[[（t）（）BuNP（OC（6）H（4）OMe-o）]（2）（2），顺式[[t）（）BuNP（OCH（2）） CH（2）OMe）]（2）（3），顺式[[（t）BuNP（OCH（2）CH（2）SMe）]（2）（4）和顺式[[t）BuNP（OCH） （2）CH（2）NMe（2））]（2）（5）通过使顺式[[（t）（）BuNPCl] [2]（1）与相应的亲核试剂反应合成。2与[M（COD）Cl（2）]的反应提供了顺式[MCl（2）（2）（2）]衍生物（M = Pd（6），Pt（7）），而与[Pd得到（NCPh）（2）Cl（2）]，反式-[MCl（2）（2）（2）]（8）。2与[Pd（PEt（3））Cl（2）]（2），[Ru（eta（6）-p-cymene）Cl（2）]（2）和[M（COD） Cl]（2）（M = Rh，Ir）提供Pd（II）（9），Ru
• Gold(i) complexes of cyclodiphosphazanes cis-{RP(μ-NtBu)}2: structure of a novel tetranuclear gold(i) macrocycle, [{Au{(o-MeOC6H4O)P(μ-NtBu)}2}4](ClO4)4
  作者：P. Chandrasekaran、Joel T. Mague、Maravanji S. Balakrishna

  DOI：10.1039/b903075a

  日期：——

  equivalents of [AuCl(SMe2)] with cyclodiphosphazanes cis-RP(μ-NtBu)}2 (1a–1d) produce binuclear gold(I) complexes of the type, [ClAuRP(μ-NtBu)}2AuCl] (2 R = OC6H4OMe-o, 3 R = OCH2CH2OMe, 4 R = NEt2, 5 R = NHtBu) in quantitative yield. A similar reaction between cis-(o-MeOC6H4O)P(μ-NtBu)}2 (1a) and [AuCl(SMe2)] in a 1 : 1 molar ratio afforded the mono-nuclear complex [ClAu(o-MeOC6H4O)P(μ-NtBu)}2] (6). Addition

  [AUCL（SME两个当量的反应2与cyclodiphosphazanes）]顺- RP（μ-N吨丁基）} 2（1A - 1D）产生双核金（我的类型的）配合物，[ClAu RP（μ- ñ吨丁基）} 2 AUCL]（2 R = OC 6 H ^ 4 OMe- ø，3 R = OCH 2 CH 2 OME，4 R = NET 2，5 R = NH吨丁基），定量收率。之间的相似的反应顺- （ø-MeOC 6 ħ 4 O）P（μ-N吨丁基）} 2（1A）和[AUCL（SME 2）]在1：得到的单核络合物[ClAu （1摩尔比ö -MeOC 6 ħ 4 O）P（μ- Nt Bu）} 2 ]（6）。在氯代衍生物2中加入两当量的CuX（X = Br，I）导致形成溴[布劳（ø -MeOC 6 ħ 4 O）P（μ-N吨丁基）} 2 AuBr]（7），和碘[IAU （ø -MeOC 6 ħ 4 O）P（μ-N吨丁基）}
• Tetranuclear Rhodium(I) Macrocycle Containing Cyclodiphosphazane [Rh₂(μ-Cl)₂(CO)₂{(<i>^t</i>BuNP(OC₆H₄OMe-<i>o</i>))₂-κP]₂ and Its Reversible Conversion into <i>trans</i>-[Rh(CO)Cl{(<i>^t</i>BuNP(OC₆H₄OMe-<i>o</i>))₂-κP}₂]
  作者：P. Chandrasekaran、Joel T. Mague、Maravanji S. Balakrishna

  DOI：10.1021/om0502537

  日期：2005.7.1

  The 1:1 reaction between cis-[(BuNP)-Bu-t(OC6H4OMe-o)](2) (2) and [Rh(mu-Cl)(CO)(2)](2) affords novel tetranuclear rhodium(l) macrocycle (3) containing two cyclodiphosphazanes bridged by two [Rh(mu-Cl)(CO)](2) moieties, whereas the corresponding 4:1 reaction affords trans-[Rh(CO)Cl-((BuNP)-Bu-t(OC6H4OMe-o))(2)-kappa P}2] (4).