(η2-cis-cyclooctene)(η6-1,3,5-triethyl-2,4,6-(tris(trimethylsilylmethyl)benzene))molybdenum(0)dicarbonyl | 139211-06-6

• 英文名称: (η2-cis-cyclooctene)(η6-1,3,5-triethyl-2,4,6-(tris(trimethylsilylmethyl)benzene))molybdenum(0)dicarbonyl
• CAS: 139211-06-6
• 化学式: C₃₄H₆₂MoO₂Si₃
• 分子量: 683.062
• InChiKey: MHMXPXNHVJDRLL-ZMKTYRQVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：
  None

反应信息

• 作为产物：
  描述：

  顺-环辛烯 、 tricarbonyl(η6-1,3,5-triethyl-2,4,6-tris(trimethylsilylmethyl)benzene)molybdenum(0) 以 苯 为溶剂， 以35%的产率得到(η2-cis-cyclooctene)(η6-1,3,5-triethyl-2,4,6-(tris(trimethylsilylmethyl)benzene))molybdenum(0)dicarbonyl
  参考文献：
  名称：

  Two different crystal and molecular structures for dicarbonyl(?2-cis-cyclooctene)[?6-1,3,5-triethyl-2,4,6-tris-(trimethylsilylmethyl)-benzene]molybdenum(0): a highly crowded but surprisingly stable molecule

  摘要：

  Two crystal and molecular structures have been determined for the sterically very crowded molecule dicarbonyl(eta-2-cis-cyclooctene)[eta-6-1,3,5-triethyl-2,4,6-tris-(trimethylsilylmethyl)-benzene]-molybdenum(0), 3 a and 3 b. In structure 3 a the crystals are monoclinic, space group P2(1)/n, whereas in 3 b they are orthorhombic, space group P2(1)2(1)2(1). In 3 a the carbon-carbon double bond of the cis-cyclooctene moiety is almost parallel to the benzene ring plane; in 3 b it is inclined at an angle of nearly 15-degrees. In both 3 a and 3 b the co-ordinated cis-cyclooctene and arene moieties adopt conformations which are very similar to those calculated to be the ground states of the free molecules.

  DOI：

  10.1007/bf00817600