The CS molecule and structure of thiocarbonyls
- 1 January 1967
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in Transactions of the Faraday Society
- Vol. 63, 257-261
- https://doi.org/10.1039/tf9676300257
Abstract
Self-consistent-field wave functions are calculated for the ground state of the CS molecule using an extended basis set. Consideration of orbital energies and linear combination coefficients indicates that the recently-prepared thiocarbonyl complexes should be more stable than the well-known carbonyls. The dipole moment of the molecule is also calculated.Keywords
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