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Intramolecular interactions and nature of the lowest electronically excited states in compounds modeling the structural unit of lignin. II. Phenolate anions

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Abstract

Quantum-chemical calculations of the electronic structures of the phenolate ions of compounds modeling lignin in the ground and electronically excited states have been made by the CNDO/S method. The intramolecular electron donor-acceptor interactions in the phenolate anion on excitation and the nature of the lowest electronically excited states are discussed on the basis of the results obtained.

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Literature cited

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Additional information

Siberian Scientific-Research Institute of Pulp and Board, Bratsk. A. A. Zhdanov Irkutsk State University. Translated from Khimiya Prirodnykh Soedinenii, No. 2, pp. 275–282, March–April, 1988.

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Burlakov, V.M., Chupka, É.I., Chuvashev, D.D. et al. Intramolecular interactions and nature of the lowest electronically excited states in compounds modeling the structural unit of lignin. II. Phenolate anions. Chem Nat Compd 24, 235–241 (1988). https://doi.org/10.1007/BF00596758

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Keywords

  • Phenolate
  • Organic Chemistry
  • Excited State
  • Structural Unit
  • Compound Modeling