[Pd(η2-2,2-diacetyl-1,1-ethylenedithiolato)(PPh3)2] | 340698-77-3

• 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: [Pd(η2-2,2-diacetyl-1,1-ethylenedithiolato)(PPh3)2]
• 英文别名: [Pd(η2-S2CC(C(O)Me)2)(PPh3)2]；[Pd(S2C=C(C(O)Me)2)(PPh3)2]；2-acetyl-3-oxobut-1-ene-1,1-dithiolate;palladium(2+);triphenylphosphane
• CAS: 340698-77-3
• 化学式: C₄₂H₃₆O₂P₂PdS₂
• 分子量: 805.246
• InChiKey: FZYIBBWBWHTPNK-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  7.36
• 重原子数：
  49
• 可旋转键数：
  8
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  36.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [Pd(η2-2,2-diacetyl-1,1-ethylenedithiolato)(PPh3)2] 、 silver perchlorate 以 丙酮 为溶剂， 以87%的产率得到[(Pd(PPh3)2)2Ag2(μ2,η2-(S,S')-(S2CC(C(O)Me)2)2)](ClO4)2
  参考文献：
  名称：

  Mononuclear (Pd, Pt), Heterodinuclear (PdAg, PtAg), and Tetranuclear (Pd₂Ag₂, Pt₂Ag₂) 1,1-Ethylenedithiolato Complexes

  摘要：

  1p;&-5q;1The reactions of [Tl-2{S2C=C{C(O)Me}(2)}](n) with [MCl2L2] (1:1) or with [MCl2(NCPh)(2)] and PPh3 (1:1:2) give complexes [M{eta (2)-S2C=C{C(O)Me}(2)}L-2] [M = Pt, L-2 = 1,5-cyclooctadiene (cod) (1); L-2 = bpy, M = Pd (2a), Pt (2b), L = PPh3, M = Pd (3a), Pt (3b)] whereas with MCl2 and QCl (2:1:2) anionic derivatives Q(2)[M{eta (2)-S2C=C(O)Me}(2)}(2)] [M = Pd, Q = NMe4 (4a), Ph3P=N=PPh3 (PPN) (4a '), M = Pt, Q = NMe4 (4b)] are produced. Complexes 1 and 3 react with AgClO4 (1:1) to give tetranuclear complexes [{ML2}(2)Ag-2-{mu (2),eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}(2)}](ClO4)(2) [L = PPh3, M = Pd (5a), Pt (5b), L-2 = cod, M = Pt (5b ')], while the reactions of 3 with AgClO4 and PPh3 (1:1:2) give dinuclear [{M(PPh3)(2)}{Ag(PPH3)(2)}{mu (2)-eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}}]ClO4 [M = Pd (6a), Pt (6b)]. The crystal structures of 3a, 3b, 4a, and two crystal froms of 5b have been determined. The two crystal forms of 5b display two {Pt(PPh3)(2)}{mu (2)-eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}(2)} moieties bridging two Ag(I) centers.

  DOI：

  10.1021/ic000996e
• 作为产物：
  描述：

  二(氰基苯)二氯化钯 、 (PPN)2[Pd(η2-2,2-diacetyl-1,1-ethylenedithiolato)2] 、 三苯基膦 以 not given 为溶剂， 以80%的产率得到[Pd(η2-2,2-diacetyl-1,1-ethylenedithiolato)(PPh3)2]
  参考文献：
  名称：

  Mononuclear (Pd, Pt), Heterodinuclear (PdAg, PtAg), and Tetranuclear (Pd₂Ag₂, Pt₂Ag₂) 1,1-Ethylenedithiolato Complexes

  摘要：

  1p;&-5q;1The reactions of [Tl-2{S2C=C{C(O)Me}(2)}](n) with [MCl2L2] (1:1) or with [MCl2(NCPh)(2)] and PPh3 (1:1:2) give complexes [M{eta (2)-S2C=C{C(O)Me}(2)}L-2] [M = Pt, L-2 = 1,5-cyclooctadiene (cod) (1); L-2 = bpy, M = Pd (2a), Pt (2b), L = PPh3, M = Pd (3a), Pt (3b)] whereas with MCl2 and QCl (2:1:2) anionic derivatives Q(2)[M{eta (2)-S2C=C(O)Me}(2)}(2)] [M = Pd, Q = NMe4 (4a), Ph3P=N=PPh3 (PPN) (4a '), M = Pt, Q = NMe4 (4b)] are produced. Complexes 1 and 3 react with AgClO4 (1:1) to give tetranuclear complexes [{ML2}(2)Ag-2-{mu (2),eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}(2)}](ClO4)(2) [L = PPh3, M = Pd (5a), Pt (5b), L-2 = cod, M = Pt (5b ')], while the reactions of 3 with AgClO4 and PPh3 (1:1:2) give dinuclear [{M(PPh3)(2)}{Ag(PPH3)(2)}{mu (2)-eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}}]ClO4 [M = Pd (6a), Pt (6b)]. The crystal structures of 3a, 3b, 4a, and two crystal froms of 5b have been determined. The two crystal forms of 5b display two {Pt(PPh3)(2)}{mu (2)-eta (2)-(S,S ')-{S2C=C{C(O)Me}(2)}(2)} moieties bridging two Ag(I) centers.

  DOI：

  10.1021/ic000996e

文献信息

• Heterodi- [MAg, MAu (M = Pd, Pt)], Tri- [PdAg₂, PtAg₂, PtAu₂, Pt₂M (M = Ni, Pt, Cd, Hg)], and Tetranuclear (Pt₂Ag₂, Pt₂Au₂) 1,1-Ethylenedithiolato Complexes
  作者：José Vicente、María Teresa Chicote、Sonia Huertas、Peter G. Jones、Axel K. Fischer

  DOI：10.1021/ic010488k

  日期：2001.11.1

  1-ethylenedithiolato complexes: [[Pt(PPh(3))(2)](2)Au(2)[S(2)C=C[C(O)Me](2)](2)](ClO(4))(2) (7), [(PtL(2))(2)M[S(2)C=C[C(O)Me](2)](2)](ClO(4))(2) [L(2) = cod, M = Pt (8), L = PPh(3), M = Hg (9)], [[Pt(PPh(3))(2)](2)[S(2)C=C[C(Me)=O](2)](2)Ni](ClO(4))(2) (10), and [[Pt(PPh(3))(2)](2)[S(2)C=C[C(Me)=O](2)](2)[M(OClO(3))(2)]] [M = Cu (11), [C(O)Me](2)] moieties but, whereas in 7 they bridge two gold(I)

  [M（PPh（3））（2）[S（2）C = C [C（O）Me]（2）]] [M = Pd（1a），Pt（1b）]与AgClO（ 4）和PPh（3）或与[Au（PPh（3））（OCMe（2））] ClO（4）提供异双核[[M（PPh（3））（2）] [M'（PPh（3 ））] [S（2）C = C [C（O）Me]（2）]] ClO（4）[M = Pd，M'= Ag（2a），M = Pt，M'= Ag（2b ），Au（4）]或三核[[M（PPh（3））（2）] [M'（PPh（3））]（2）[S（2）C = C [C（O）Me] （2）]]（ClO（4））（2）[M = Pd，M'= Ag（3a），M = Pt，M'= Ag（3b），Au（5）] 1,1-乙撑二硫杂醇络合物，取决于试剂的摩尔比。我们最近报告说，在没有添加PPh（3）的情况下，[Pt [S（2）C = C [C（O）Me]（2）]