Aromatic Metal-Centered Monocyclic Boron Rings: Co©B8- and Ru©B9-

被引：192

作者：

Romanescu, Constantin ^{[2
]}

Galeev, Timur R. ^{[1
]}

Li, Wei-Li ^{[2
]}

Boldyrev, Alexander I. ^{[1
]}

Wang, Lai-Sheng ^{[2
]}

机构：

[1] Utah State Univ, Dept Chem & Biochem, Logan, UT 84322 USA

[2] Brown Univ, Dept Chem, Providence, RI 02912 USA

来源：

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION | 2011年 / 50卷 / 40期

基金：

美国国家科学基金会;

关键词：

aromaticity; boron; cluster compounds; coordination modes; transition metals; PLANAR CARBON; AB-INITIO; CLUSTERS; TRANSITION; CATIONS; COBALT; IRON;

D O I：

10.1002/anie.201104166

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Perfect symmetry: Photoelectron spectroscopy and theoretical calculations show that the B8 and B9 rings are stabilized by the metal atoms in CoB8- and RuB9-, which possess D8h and D9h symmetry, respectively (see picture). The bonding between the metal atom and the boron ring is described by six delocalized σ electrons and six delocalized π electrons, which result in double aromaticity. © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

引用

页码：9334 / 9337

页数：4

共 31 条

[1] [Anonymous], ANGEW CHEM
[2] [Anonymous], 2004, GAUSSIAN 03 REV C 02
[3] Carbon avoids hypercoordination in CB6-, CB62-, and C2B5- planar carbon-boron clusters
Averkiev, Boris B.
Zubarev, Dmitry Yu.
Wang, Lei-Ming
Huang, Wei
Wang, Lai-Sheng
Boldyrev, Alexander I.
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2008, 130 (29) : 9248 - +
[4] Systematic ab initio investigation of bare boron clusters: Determination of the geometry and electronic structures of B-n (n=2-14)
Boustani, I
[J]. PHYSICAL REVIEW B, 1997, 55 (24) : 16426 - 16438
[5] Planar hexacoordinate carbon: A viable possibility
Exner, K
Schleyer, PV
[J]. SCIENCE, 2000, 290 (5498) : 1937 - 1940
[6] Frisch M.J., 2009, GAUSSIAN 09
[7] Peculiar covalent bonds in α-rhombohedral boron
Fujimori, M
Nakata, T
Nakayama, T
Nishibori, E
Kimura, K
Takata, M
Sakata, M
[J]. PHYSICAL REVIEW LETTERS, 1999, 82 (22) : 4452 - 4455
[8] Huang W, 2010, NAT CHEM, V2, P202, DOI [10.1038/nchem.534, 10.1038/NCHEM.534]
[9] Icosahedral packing of B12 icosahedra in boron suboxide (B6O)
Hubert, H
Devouard, B
Garvie, LAJ
O'Keeffe, M
Buseck, PR
Petuskey, WT
McMillan, PF
[J]. NATURE, 1998, 391 (6665) : 376 - 378
[10] Cyclic Boron Clusters Enclosing Planar Hypercoordinate Cobalt, Iron, and Nickel
Ito, Keigo
Pu, Zhifeng
Li, Qian-Shu
Schleyer, Paul Von Rague
[J]. INORGANIC CHEMISTRY, 2008, 47 (23) : 10906 - 10910

← 1 2 3 4 →