Keywords
DFT calculations
housene
phosphorus
silicon
tricyclo[2.1.0.025]pentane
X-ray diffraction
Abstract
The phosphatetrasilatricyclo[2.1.0.02,5]pentane cage compound was synthesized by the reaction of the tetrasilacyclobutadiene dianion dipotassium salt precursor with PCl3. The structure, bonding nature, and mechanism of formation of the title compound were studied both experimentally (NMR, X-ray) and computationally (DFT).
References
1.
Chiang J.F., Kratus M.T., Andreassen A.L., Bauer S.H.
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics,
1972
2.
A Main-Group Analogue of Housene: The Subtle Influence of the Inert-Pair Effect in Group 15 Clusters
Fish C., Green M., Jeffery J.C., Kilby R.J., Lynam J.M., McGrady J.E., Pantazis D.A., Russell C.A., Willans C.E.
Angewandte Chemie - International Edition,
2006
3.
Krachko T., Ehlers A.W., Nieger M., Lutz M., Slootweg J.C.
Angewandte Chemie - International Edition,
2018
4.
Sekiguchi A., Matsuo T., Watanabe H.
Journal of the American Chemical Society,
2000
5.
Lee V.Y., Sugasawa H., Gapurenko O.A., Minyaev R.M., Minkin V.I., Gornitzka H., Sekiguchi A.
Chemistry - A European Journal,
2016
6.
Lee V.Y., Ota K., Ito Y., Gapurenko O.A., Sekiguchi A., Minyaev R.M., Minkin V.I., Gornitzka H.
Journal of the American Chemical Society,
2017
7.
Lee V.Y., Takanashi K., Matsuno T., Ichinohe M., Sekiguchi A.
Journal of the American Chemical Society,
2004
8.
Sheldrick G.M.
Acta Crystallographica Section A Foundations of Crystallography,
1990
9.
Sheldrick G.M.
Acta Crystallographica Section A Foundations of Crystallography,
2007
10.
Sheldrick G.M.
Acta crystallographica. Section C, Structural chemistry,
2015
11.
Gaussian 16, Revision C.01, Gaussian, Wallingford, CT, 2019.
12.
Pyykkö P., Atsumi M.
Chemistry - A European Journal,
2009
13.
Levin M.D., Kaszynski P., Michl J.
Chemical Reviews,
2000
14.
Takanashi K., Lee V.Y., Ichinohe M., Sekiguchi A.
Chemistry Letters,
2007
15.
Gapurenko O.A., Lee V.Y., Minyaev R.M., Minkin V.I., Sekiguchi A.
Tetrahedron Letters,
2017