Can carbon monoxide polymerize? A theoretical investigation of polyketone

被引：19

作者：

Frapper, G

Cu, CX

Halet, JF

Saillard, JY

Kertesz, M

机构：

[1] NATL RES COUNCIL CANADA, STEACIE INST MOL SCI, OTTAWA, ON K1A 0R9, CANADA

[2] UNIV RENNES 1, LCSIM, UMR 6511, F-35042 RENNES, FRANCE

[3] GEORGETOWN UNIV, DEPT CHEM, WASHINGTON, DC 20057 USA

[4] ALLIED SIGNAL INC, RES & TECHNOL, MORRISTOWN, NJ 07962 USA

来源：

CHEMICAL COMMUNICATIONS | 1997年 / 20期

关键词：

D O I：

10.1039/a705721k

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

State of the art ab initio calculations on R(CO)(n)R (R = H, Me; n = 1-11) indicate that the hypothetical polymer of carbon monoxide, poly-CO, would be energetically less stable than the molecular form only by a few kcal mol(-1), making it a plausible stable allotropic form of CO.

引用

页码：2011 / 2012

页数：2

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