[Ru(CO)2][Ru(CO)2Cl](η(5),η(5):η(1)-C5H4C(CH3)2C5H3) | 178414-47-6

• 英文名称: [Ru(CO)2][Ru(CO)2Cl](η(5),η(5):η(1)-C5H4C(CH3)2C5H3)
• 英文别名: [Ru(CO)2][Ru(CO)2Cl][η(5),η(5):η(1)-C5H4(CH3)2CC5H3]
• CAS: 178414-47-6
• 化学式: C₁₇H₁₃ClO₄Ru₂
• 分子量: 518.881
• InChiKey: ZQLFGDBRTDXQCT-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  氯仿 、 Ru2(CO)4(η(5),η(5)-C5H4(CH3)2CC5H4) 以 氯仿 、 苯 为溶剂， 以99%的产率得到[Ru(CO)2][Ru(CO)2Cl](η(5),η(5):η(1)-C5H4C(CH3)2C5H3)
  参考文献：
  名称：

  Photoinduced rearrangements of ring-coupled bis(cyclopentadienylrutheniumdicarbonyl) compounds of the form Ru2(CO)4(η5,η5-C5H4LC5H4) (L  CHn2-, (CH3)2C-, C2H4- and (CH3)2S-) The molecular structure of [Ru(CO)2][Ru(CO)2Cl](η5,η5:η1-C5H4CH2C5H3)

  摘要：

  Compounds of the general form Ru-2(CO)(4)(eta(5),eta(5)-C(5)H(4)LC(5)H(4)), where L = CH2-, (CH3)(2)C-, C2H4- and (CH3)(2)Si-, have been found to undergo photolysis in deuterobenzene or deuterotoluene to give 'twisted' ruthenium hydride complexes of the form [Ru(CO)(2)][Ru(CO)(2)H](eta(5),eta(5):eta(1)-C(5)H(4)LC(5)H(3)). Reaction of these hydrides with chlorocarbons resulted in the formation of the corresponding chlorides which could be isolated and characterized by IR, H-1 and C-13 NMR, mass spectrometry, and elemental analysis. In the particular case of Ru-2(CO)(4)[eta(5),eta(5)-C5H4(CH3)(2)SiC5H4] a secondary photochemical reaction occurs with formation of [Ru(CO)(2)](2)(mu-eta(5):eta(1)-C5H4)[mu-(CH3)(2)Si-(eta(5)-C5H4)] in which Ru-Ru and Cp-Si bonds have been broken and new Ru-Cp and Ru-Si bonds formed. The molecular structure of [Ru(CO)(2)][RU(CO)(2)Cl](eta(5),eta(5):eta(1)-C5H4CH2C5H3) was determined by X-ray crystallography:monoclinic, Cc, a = 27.636(5) Angstrom, b = 9.058(2) Angstrom, c = 14.545(5) Angstrom, beta = 120.85(3)degrees, V = 3126(2) Angstrom(3), Z = 8, R(F)= 2.29%.

  DOI：

  10.1016/0022-328x(95)06018-r

文献信息

• Synthesis of mono- and bimetallic ruthenium carbonyl compounds from ring-coupled bis(cyclopentadienyl thallium) reagents. The molecular structures of [Ru(CO)2][Ru(CO)2Cl][η5, η5:η1-C5H4(CH2)2CC5H3], Ru2(CO)4[η5, η5-C5H4(CH3)2SiC5H4] and [Ru(CO)2Br][Ru(CO)2Cl][η5, η5-C5H4C2H4C5H4]
  作者：Thomas E. Bitterwolf、Maureen B. Leonard、Pamela A. Horine、Joyce E. Shade、Arnold L. Rheingold、Donna J. Staley、Glenn P.A. Yap

  DOI：10.1016/0022-328x(95)06007-j

  日期：1996.4

  C2H4−, with [Cl2Ru(CO)3]2 was found to form a family of mono- and bimetallic complexes including compounds of the form: Ru2(CO)4(η5,η5C5H4LC5H4), Ru(CO)2(η5,η5:1C5H4LC 5H4), [Ru(CO)2][(CO)2Cl](η5,η5:η1C5H4LC5H3), and [Ru(CO)2Cl]2(η5,η5C5H4LC5H4). These compounds have been completely characterized by IR, 1H and 13C NMR, mass spectrometry and elemental analysis. The molecular structures of several compounds

  通式为Tl 2 [C 5 H 4 LC 5 H 4 ]的环偶联双（环戊二烯基th）化合物的反应，其中L = CH 2 -，（CH 3）2 C-，（CH 3）2 Si-， c ^ 2 ħ 4 - ，其中[氯2的Ru（CO）3 ] 2，发现组成家庭单-和双金属络合物，包括以下形式的化合物的：孺2（CO）4（η 5，η 5 C 5 H 4 LC5 ħ 4），钌（CO）2（η 5，η 5：1 C 5 ħ 4 LC 5 ħ 4），的[Ru（CO）2 ] [（CO）2 CL]（η 5，η 5： η 1 C 5 ħ 4 LC 5 ħ 3），和的[Ru（CO）2 CL] 2（η 5，η 5 C 5 ħ 4 LC 5 ħ 4）。这些化合物已通过IR，1 H和13 C NMR，质谱法和元素分析完全表征。已确定该系列中几种化合物的分子结构：。孺2（CO）4 [η 5，η 5 C 5 ħ 4（CH 3）2的SiC