• Media type: E-Article
  • Title: Revisiting the electronic structure of N2-bound cAAC-borylene at the CASSCF level: a detailed bonding picture of borylene–N2 interaction
  • Contributor: Ghosh, Susovon; Bhardwaj, Akhil; Mondal, Bhaskar
  • Published: Royal Society of Chemistry (RSC), 2023
  • Published in: Dalton Transactions, 52 (2023) 35, Seite 12517-12525
  • Language: English
  • DOI: 10.1039/d3dt01155k
  • ISSN: 1477-9226; 1477-9234
  • Origination:
  • Footnote:
  • Description: A detailed synergistic bonding picture between cAAC-stabilised borylene and N2 has been established through orbitals derived from multiconfigurational CASSCF calculations accounting for the non-dynamic electron correlation.