4.8 Article

Discovery of a Missing Link: Detection and Structure of the Elusive Disilicon Carbide Cluster

Journal

JOURNAL OF PHYSICAL CHEMISTRY LETTERS
Volume 6, Issue 11, Pages 2107-2111

Publisher

AMER CHEMICAL SOC
DOI: 10.1021/acs.jpclett.5b00770

Keywords

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Funding

  1. NASA [NNX13AE59G]
  2. NSF [DGE1144083]
  3. Welch Foundation of Houston, Texas [F-1283]
  4. U.S. National Science Foundation [CHE-1361031]
  5. Deutsche Forschungsgemeinschaft (DFG) [TH 1301/3-1, TH 1301/3-2]
  6. Direct For Mathematical & Physical Scien
  7. Division Of Chemistry [1361031] Funding Source: National Science Foundation

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The rotational spectrum of the elusive but fundamentally important silicon carbide SiCSi has been detected using sensitive microwave techniques aided by high-level ab initio methods. Its equilibrium structure has been determined to very high precision using isotopic substitution and vibrational corrections calculated quantum-chemically: it is an isosceles triangle with a Si-C bond length of 1.693(1) angstrom, and an apex angle of 114.87(5)degrees. Now that all four SimCn clusters with m + n = 3 have been observed experimentally, their structure and chemical bonding can be rigorously compared. Because Si2C is so closely linked to other Si-bearing molecules that have been detected in the evolved carbon star IRC+10216, it is an extremely promising candidate for detection with radio telescopes.

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