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Heats of Formation for the Boronic Acids R–B(OH)(2) and Boroxines R(3)B(3)O(3) (R=H, Li, HBe, H(2)B, H(3)C, H(2)N, HO, F, and Cl) Calculated at the G2, G3, and G4 Levels of Theory

Boronic acids (R–B(OH)(2)) and their boroxine (R(3)B(3)O(3)) dehydration products have emerged as important classes of compounds with a multitude of diverse applications. However, the available heats of formation for these compounds are not always as accurate as would be required for further use. In...

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Bibliographic Details
Main Authors: Bock, Charles W., Larkin, Joseph D.
Format: Artigo
Language:Inglês
Published: 2012
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC3956662/
https://ncbi.nlm.nih.gov/pubmed/24653975
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.comptc.2012.02.007
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