物理化学学报 >> 2000, Vol. 16 >> Issue (09): 804-809.doi: 10.3866/PKU.WHXB20000909

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若干Sc络合物的空间群

Ng Seikweng, 胡盛志   

  1. 马来亚大学研究生院 50603 Kuala Lumpur，马来西亚|厦门大学化学系，厦门 361005
  • 收稿日期:1999-12-02 修回日期:2000-03-27 发布日期:2000-09-15
  • 通讯作者:

Space Groups of some Scandium Complexes

Ng  Seikweng, Hu  Sheng-Zhi   

  1. Institute of Postgraduate Studies Research,University of Malaya,Kuala Lumpur 50603,Malaysia|Department of Chemistry,Xiamen University,Xiamen 361005
  • Received:1999-12-02 Revised:2000-03-27 Published:2000-09-15
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摘要：

通过模拟结构因子计算将[(C4H9)4N][Sc(NCS)6]•3.5H2O的空间群从正交晶系的Pcab修正为立方晶系的Pa3.将Sc(C17H13N2O2)3和[(H2O)10(OH)2Sc2](C6H5SO3)4•4H2O从P1修正为C2/c.还将[Sc(NO3)3(H2O)3]•18-Crown-6的Pna21修正为Pnma.

关键词: 空间群修正, 模拟结构因子, 钪络合物

Abstract:

The space group of [(C4H9)4N]3[Sc(NCS)6]• 3.5 H2O is revised from orthorhombic Pbca to cubic Pa by solving the cubic structure from the structure factors that are simulated from the orthorhombic structure. The space groups of three other scandium(III) structures that were originally reported in lower- symmetry settings are revised to higher- symmetry centrosymmetric settings: Sc(PMBP)3(HPMBP=1- phenyl- 3- methyl- 4- benzoylpyrazol- 5- one)from P to C 2/c, [(H2O)10(OH)2Sc2] (C6H5SO3)4•4H2O from P1 to C 2/c and [Sc(NO3)3(H2O)3]• 18- crown- 6 from Pna21 to Pnma.

Key words: Space group revision, Simulated structure factors, Scandium complexes