| 147042-17-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 147042-17-9
• 化学式: BiCl₄*C₃₆H₃₀NP₂
• 分子量: 889.381
• InChiKey: PTAYJBIKIKETME-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  9.45
• 重原子数：
  44.0
• 可旋转键数：
  7.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  12.36
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  、 以 not given 为溶剂， 生成
  参考文献：
  名称：

  Anionic, four-co-ordinate, ten-electron bismuth complexes: aspects of synthesis, structure and bonding

  摘要：

  The reaction between [BiCl{Fe(CO)2(eta-C5H5)}2] 1 and 1 equivalent of [N(PPh3)2]Cl afforded the ionic complex [N(PPh3)2][BiCl2{Fe(CO)2(eta-C5H5)}2] 2. The [NMe4]+ salt, [NMe4][BiCl2{Fe(CO)2(eta-C5H5)}2] 3, was prepared similarly. An analogous bromide derivative, [PPh4][BiBr2{Fe(CO)2(eta-C5H5)}2] 4, was prepared from the reaction between [BiBr{Fe(CO)2(eta-C5H5)}2] 5 and [PPh4]Br. The reaction between [BiCl{Mo(CO)3(eta-C5H5)}2] 7 and 1 equivalent of [N(PPh3)2]Cl afforded the complex [N(PPh3)2][BiCl2(Mo(CO)3(eta-C5H5)}2] 8, that between [PPh3(CH2Ph)]Cl and 7 afforded [PPh3(CH2Ph)] [BiCl2(Mo(CO)3(eta-C5H5)}2] 9. In tetrahydrofuran (thf) solution some degree of dissociation of [Mo(CO)3(eta-C5H5)]- is observed for 8 and 9. The bromide complexes [PPh4][BiBr2{Mo(CO)3(eta-C5H5)}2] 10 and [NBun4][BiBr2{Mo(CO)3(eta-C5H5)}2] 11 were prepared from the reactions between [BiBr{Mo(CO)3(eta-C5H5)}2] 12 and 1 equivalent of [PPh4]Br and [NBun4]Br respectively. The tungsten complexes [N(PPh3)2][BiCl2{W(CO)3(eta-C5H5)}2] 13 and [PPh3(CH2Ph)][BiCl2{W(CO)3(eta-C5H5)}2] 14 were similarly prepared. Spectroscopic data for the complexes [N(PPh3)2][BiCl3(Mo(CO)3(eta-C5H5)}] 16 and [N(PPh3)2][BiCl3{W(CO)3(eta-C5H5)}] 17 are also presented. The structures of compounds 2,8,9 (as a thf solvate) and 13 were determined by X-ray crystallography. The structures of all of the compounds comprise a four-co-ordinate bismuth centre bonded to two chlorine atoms and two ML(n) fragments. The precise co-ordination geometries, however, vary from close to an idealised equatorially-vacant trigonal bipyramid (disphenoidal), 2 and 9, with axial chlorines and equatorial metal centres, to nearly tetrahedral, 8 and 13. These results are incorporated into a general discussion of the structures found for AB4E complexes, i.e. four-co-ordinate with ten valence electrons, and some ideas are advanced on possible electronic factors which determine the particular geometry adopted.

  DOI：

  10.1039/dt9920003515
• 作为产物：
  描述：

  氯化铋 、 双(三苯基正膦基)氯化铵 以 二氯甲烷 为溶剂， 以83%的产率得到
  参考文献：
  名称：

  Errington, R. John; Fisher, George A.; Norman, Nicholas C., Zeitschrift fur Anorganische und Allgemeine Chemie

  摘要：

  DOI：

文献信息

• Synthetic and structural studies on bismuth(III) thiocyanate and selenocyanate complexes
  作者：Alessandra Crispini、R. John Errington、George A. Fisher、Frank J. Funke、Nicholas C. Norman、A. Guy Orpen、Susan E. Stratford、Oliver Struve

  DOI：10.1039/dt9940001327

  日期：——

  dark red crystals of a complex formulated as Bi(SeCN)3. The reaction between Bi(SeCN)3 and 2 equivalents of [BiMo(CO)3(η-C5H5)}3] afforded [Bi(SeCN)Mo(CO)3(η-C5H5)}2]. The reaction of [N(PPh3)2][BiCl4] and 4 equivalents of KSeCN afforded a dark red crystalline compound K[N(PPh3)2]2[Bi(SeCN)6] the structure of which was also established by X-ray crystallography and comprises isolated [N(PPh3)2]+ cations

  BiCl 3或Bi（NO 3）3 ·5H 2 O与3当量的KSCN之间的反应提供了黄色材料，该材料尚未完全表征，但会作为Bi（SCN）3 A的源进行反应。化合物阿和2个当量的K [沫（CO）3（η-C 5 H ^ 5）]，得到绿色的络合物[双（SCN）沫（CO）3（η-C 5 H ^ 5）} 2 ]，其具有由X射线晶体学表征，由通过一个硫与一个SCN基团配位的两个三角金字塔形铋中心和两个Mo（CO）3（η-C5 H 5）具有额外的分子间Bi⋯NCS相互作用的片段，从而形成一维聚合物。之间的反应甲[（18-冠-6）K]和SCN（18-冠-6 = 1,4,7,10,13,16- hexaoxacyclooctadecane）得到橙色和黄色结晶材料两者都具有一直通过X射线晶体学表征并且显示为异构体。在橙色化合物中，钾阳离子位于两个由18-crown-6配体配位的钾阳离子之间，并且存在八面体[Bi（SCN）