N-[[2,6-di(propan-2-yl)phenyl]imino-diphenyl-lambda5-phosphanyl]-2,6-di(propan-2-yl)aniline | 1421829-37-9

• 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: N-[[2,6-di(propan-2-yl)phenyl]imino-diphenyl-lambda5-phosphanyl]-2,6-di(propan-2-yl)aniline
• 英文别名: N-[[2,6-di(propan-2-yl)phenyl]imino-diphenyl-λ5-phosphanyl]-2,6-di(propan-2-yl)aniline
• CAS: 1421829-37-9
• 化学式: C₃₆H₄₅N₂P
• 分子量: 536.74
• InChiKey: QLNWFVXIZJOPBX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.3
• 重原子数：
  39
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  24.4
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-[[2,6-di(propan-2-yl)phenyl]imino-diphenyl-lambda5-phosphanyl]-2,6-di(propan-2-yl)aniline 以 正己烷 、 正庚烷 、 甲苯 为溶剂， 反应 0.5h， 生成
  参考文献：
  名称：

  立体需要二亚氨基次膦酸酯配体稳定的二聚锌（I）化合物的合成，结构和反应活性

  摘要：

  新的空间要求aminoiminophosphorane博士2 P（NDip）（NHDip）（DIP = C 6 H ^ 3 -2,6-我镨2 ; LH，1）已经被制备为前体钾络合物[LK]（2）和一系列杂合锌（II）配合物，即[（LZnBr）2 ]（3），[LZnMe]（4），[LZnEt]（5）和[（LZnI）2 ]（6）。使用络合物2和ZnBr 2通过盐易位途径获得产物，得到化合物3通过配体前体1和ZnR 2（R = Me或Et）的直接反应分别生成配合物4或5，或通过使用I 2对配合物4或5进行碘化得到化合物6。通过使用二聚镁（I）化合物作为选择性，化学计量和可溶性还原剂还原杂合锌（II）卤化物配合物3或6，可得到新的锌（I）二聚体[（LZn）2 ]（7）。良品率高。化合物1 – 7进行了晶体学和光谱学表征，并研究了亚氨基次膦酸酯配体的配位行为，并将其与相关的基于CN的配体进行了比较。已经通过小规模反应对[[LZn）2

  DOI：

  10.1002/chem.201202560
• 作为产物：
  描述：

  N-(2,6-diisopropylphenyl)-1,1-diphenylphosphanamine 、 2,6-diisopropyl-1-azidobenzene 以 甲苯 为溶剂， 生成 N-[[2,6-di(propan-2-yl)phenyl]imino-diphenyl-lambda5-phosphanyl]-2,6-di(propan-2-yl)aniline
  参考文献：
  名称：

  空间要求高的二亚氨基次膦酸碱金属配合物的结构多样性

  摘要：

  我们制备了新的氨基膦Ph2PNHMes 2 [Mes = mesityl (2,4,6-Me3C6H2)]和氨基亚氨基膦Ph2P(=NMes)NHMes 4 (MesLH)，并获得了新的碱金属配合物[(DipLLi)2] 5 [DipL = Ph2P(NDip)2, Dip = 2,6-iPr2C6H3], [(MesLLi)2] 6, [(DipL)(DipN2L)Li2] 7 [DipN2L = Ph2P(NDip)(N3Dip)], [ (DipN2L)2Li2] 8, [DipLLi(THF)] 9, [DipLLi(THF)2] 10, [(DipLNa)2] 11, [(MesLNa)n] 12, [DipLNa(THF)2] 13, [ {MesLNa(THF)}2] 14 和 [MesLK] 16 通过在各种溶剂中用标准强碱金属碱去质子化它们各自的配体前体。报道了 2、4-6、7·8、9-14

  DOI：

  10.1002/ejic.201402924

文献信息

• Thermally Activated Delayed Fluorescence and Phosphorescence Quenching in Iminophosphonamide Copper and Zinc Complexes
  作者：Bhupendra Goswami、Thomas J. Feuerstein、Ravi Yadav、Sergei Lebedkin、Pit J. Boden、Sophie T. Steiger、Gereon Niedner‐Schatteburg、Markus Gerhards、Manfred M. Kappes、Peter W. Roesky

  DOI：10.1002/chem.202101247

  日期：2021.11.2

  temperatures can be described within the thermally activated delayed fluorescence (TADF) scheme. However, unusually, the fluorescence is nearly absent in two complexes and the low-lying triplet state quenches PL. Some excited states were further investigated by time-resolved FTIR spectroscopy and quantum chemical calculations.

  发光或不发光：提供手性亚氨基膦酰胺铜和锌络合物。在低温下研究的一些稳态和时间分辨光致发光（PL）特征可以在热激活延迟荧光（TADF）方案中描述。然而，不同寻常的是，两个配合物中几乎不存在荧光，并且低位三重态会淬灭 PL。通过时间分辨 FTIR 光谱和量子化学计算进一步研究了一些激发态。
• Thorium(<scp>iv</scp>) trialkyl complexes of non-carbocyclic ligands as highly active isoprene polymerisation catalysts
  作者：Guorui Qin、Jianhua Cheng

  DOI：10.1039/c9dt01617a

  日期：——

  5-dimethyl-1-pyrazolyl)borate (TpMe2) were used to stabilize the corresponding thorium(IV) trialkyl complexes [PhC(NDipp)2]Th(CH2SiMe3)3 (1), [Ph2P(NDipp)2]Th(CH2SiMe3)3 (2), [Ph2P(NDipp)]Th(p-CH2-C6H4-Me)3 (3) and (TpMe2)Th(CH2SiMe3)3 (4), which were characterized by NMR spectroscopy and single-crystal X-ray analysis. Complexes 1–4 in combination with [Ph3C][B(C6F5)4] and AliBu3 form non-Cp-ligated actinide

  一系列单阴离子非碳环配体，包括双齿苯甲酰胺酸盐[PhC（NDipp）2 ]（Dipp = C 6 H 3 -2,6- i Pr 2），亚氨基次膦酰胺[Ph 2 P（NDipp）2 ]和膦酰胺[Ph 2 PNDipp]和三齿氢三（3,5-二甲基-1-吡唑基）硼酸酯（Tp Me2）用于稳定相应的or （IV）三烷基络合物[PhC（NDipp）2 ] Th（CH 2 SiMe 3）3（1），[Ph 2 P（NDipp）2 ] Th（CH 2SiMe 3）3（2），[Ph 2 P（NDipp）] Th（p -CH 2 -C 6 H 4 -Me）3（3）和（Tp Me2）Th（CH 2 SiMe 3）3（4） ，由NMR光谱和单晶X射线分析表征。配合物1-4与[Ph 3 C] [B（C 6 F 5）4 ]和Al i Bu 3结合形成非Cp连接的act系催化剂体系，对于异戊二烯的聚合反应显示出高活性和高顺式-1
• Isoprene Polymerization with Iminophosphonamide Rare-Earth-Metal Alkyl Complexes: Influence of Metal Size on the Regio- and Stereoselectivity
  作者：Bo Liu、Guangping Sun、Shihui Li、Dongtao Liu、Dongmei Cui

  DOI：10.1021/acs.organomet.5b00502

  日期：2015.8.24
• 3,4-Polymerization of Isoprene by Using NSN- and NPN-Ligated Rare Earth Metal Precursors: Switching of Stereo Selectivity and Mechanism
  作者：Bo Liu、Lei Li、Guangping Sun、Jingyao Liu、Meiyan Wang、Shihui Li、Dongmei Cui

  DOI：10.1021/ma501085c

  日期：2014.8.12

  The rare-earth metal complexes bearing NSN-bidentate beta-diimidosulfonate ligands (RNSNdipp)Ln-(CH2SiMe3)(2)(THF)(n) (R = Ph, Ln = Lu (1a), n = 1, Y (1b), n = 2, Sc (1c), n = 1; R = PhNMe2, Ln = Lu (1d), n = 1) were synthesized by treatment of the ion-pairs [Ln(CH2SiMe3)(2)(THF)(x)][BPh4] with equimolar amount of the ligand lithium salts (RNSNdipp)Li(THF)(2) (NSNdipp = S((NC6H4Pr2)-Pr-i-2,6)(2)). Addition reaction between lutetium tris(alkyl)s, Ln(Z)(3)(THF)(n) and NSNdipp gave the corresponding dialkyl complexes (ZNSN(dipp))Lu(Z)(2)(THF)(n) (Z = CH2SiMe3, n = 1 (le); Z = o-CH2C6H4NMe2, n = 0 (1f)). Deprotonation of beta-imidophosphonamido ligands H-NPNdipp and H-NPNdipp (NPNdipp = Ph2P(NC(6)H(3)(i)Pr2-2,6)(2), NPNEt = PPh2((NC6H3Pr2)-Pr-i-2,6)(NC6H4-Et-2)) with Lu(CH2SiMe3)(3)(THF)2 yielded the corresponding dialkyl complexes (NPNdipp)Lu(CH2SiMe3)(2)(THF) (2) and (NPNEt)Lu(CH2SiMe3)(2)(THF) (3). All the complexes had been structurally well-defined, and 1a, 1b, 1e, 2, and 3 were further characterized by X-ray diffraction analysis where the almost planar NSN rare-earth metal unit is C-s (or pseudo C-s) symmetry with the two alkyl groups arranging on both sides and a coordinated THF against it. Upon activation with [PhMe2NH][B(C6F5)(4)] and (AlBu3)-Bu-i, all these complexes exhibited high 3,4-regioselectivity (ranging from 91% to >99%) for the polymerization of isoprene. Moreover, the excellent isospecific selectivity up to mmmm > 99% have been achieved with complexes 1 depending on the electronics of the sulfur substituents to give crystalline polyisoprene with the highest T-m (170 degrees C) reported to date. The NPN-bidentate beta-imidophosphonamide ligated rare-earth metal complexes provide both high syndio- and iso- 3,4-selectivities (3,4 > 99%, rr = 66%, mmmm = 96%) depending on the frameworks, steric environment and geometry of the ligands. The regio- and stereo- selective mechanisms proceeded in these systems were explicated by DFT simulation.
• Synthesis, Structure, and Reactivity of a Dimeric Zinc(I) Compound Stabilized by a Sterically Demanding Diiminophosphinate Ligand
  作者：Andreas Stasch

  DOI：10.1002/chem.201202560

  日期：2012.11.19

  The new sterically demanding aminoiminophosphorane Ph2P(NDip)(NHDip) (Dip=C6H3‐2,6‐iPr2; LH, 1) has been prepared as a precursor to the potassium complex [LK] (2) and a series of heteroleptic zinc(II) complexes, namely [(LZnBr)2] (3), [LZnMe] (4), [LZnEt] (5), and [(LZnI)2] (6). The products have been obtained either through a salt metathesis route by using complex 2 and ZnBr2 to give compound 3,

  新的空间要求aminoiminophosphorane博士2 P（NDip）（NHDip）（DIP = C 6 H ^ 3 -2,6-我镨2 ; LH，1）已经被制备为前体钾络合物[LK]（2）和一系列杂合锌（II）配合物，即[（LZnBr）2 ]（3），[LZnMe]（4），[LZnEt]（5）和[（LZnI）2 ]（6）。使用络合物2和ZnBr 2通过盐易位途径获得产物，得到化合物3通过配体前体1和ZnR 2（R = Me或Et）的直接反应分别生成配合物4或5，或通过使用I 2对配合物4或5进行碘化得到化合物6。通过使用二聚镁（I）化合物作为选择性，化学计量和可溶性还原剂还原杂合锌（II）卤化物配合物3或6，可得到新的锌（I）二聚体[（LZn）2 ]（7）。良品率高。化合物1 – 7进行了晶体学和光谱学表征，并研究了亚氨基次膦酸酯配体的配位行为，并将其与相关的基于CN的配体进行了比较。已经通过小规模反应对[[LZn）2