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Isolating Free Carbenes, their Mixed Dimers and Organic Radicals
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Isolating Free Carbenes, their Mixed Dimers and Organic Radicals

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A computational study to determine the role of σ-hole in Br/OH substituted nido-carborane and its binding

Archan Ravi Sankar1, Sermarajan Arunachalam1, Ramachandran Gnanasekaran1

  • 1Vellore Institute of Technology, Chennai, India.

Journal of Molecular Graphics & Modelling
|December 1, 2023
PubMed

Keywords:
Binding energyDFTnido-carboranesnido-heteroboranesσ-hole

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