Theoretical search for very short metal-actinide bonds:: NUIr and isoelectronic systems

被引:44
作者
Gagliardi, L
Pyykkö, P
机构
[1] Univ Palermo, Dept Phys Chem F Accascina, I-90128 Palermo, Italy
[2] Univ Helsinki, Dept Chem, Helsinki 00014, Finland
关键词
computer chemistry; density functional calculations; iridium; multiple bonding; uranium;
D O I
10.1002/anie.200353261
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Cumulated triple bonds: A new class of molecules, the isoelectronic series of NUIr, (depicted) has been postulated and theoretically studied. The bond between the actinide and the 5d-metal atom is very short and is shown to correspond to triple bonding. The N-U bond is also a triple bond.
引用
收藏
页码:1573 / 1576
页数:4
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