Quantum chemical simulation for the mechanism of benzene bromination
Nesterov, I. D., Belen’kii, L. I., Pivina, T. S.
Published in Russian chemical bulletin (01.06.2021)
Published in Russian chemical bulletin (01.06.2021)
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Journal Article
Quantum chemical studies of azoles 13. Specific solvation effect on the calculated energetic parameters of the electrophilic substitution mechanism in thiazole via elimination–addition schemes
Belen’kii, L. I., Nesterov, I. D., Chuvylkin, N. D.
Published in Russian chemical bulletin (01.11.2018)
Published in Russian chemical bulletin (01.11.2018)
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Quantum chemical studies of azoles 8. Effect of N(2)-methyl substituent on the calculated thermodynamic parameters of electrophilic substitution in tetrazole according to the elimination–addition scheme without preceding formation of N-protonated azolium salts
Belen’kii, L. I., Subbotin, A. N., Chuvylkin, N. D.
Published in Russian chemical bulletin (01.07.2016)
Published in Russian chemical bulletin (01.07.2016)
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Quantum chemical studies of azoles 7. N-alkyl substituent effect on calculated thermodynamic parameters of the electrophilic substitution mechanism in 1H-tetrazole via elimination–addition scheme without preceding formation of N-protonated azolium salts
Chuvylkin, N. D., Subbotin, A. N., Belen’kii, L. I.
Published in Russian chemical bulletin (01.07.2016)
Published in Russian chemical bulletin (01.07.2016)
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Journal Article
Quantum-chemical investigation of the electrophile affinity of molecules of five-membered heterocycles with one hetero-atom and some model systems
Belen'kii, L. I, Nesterov, I. D, Chuvylkin, N. D
Published in Chemistry of heterocyclic compounds (New York, N.Y. 1965) (01.11.2008)
Published in Chemistry of heterocyclic compounds (New York, N.Y. 1965) (01.11.2008)
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Quantum chemical studies of azoles 5. Electrophilic substitution in tetrazole and 1, 2, 4-triazole: the influence of basis set on calculated thermodynamic parameters of the elimination—addition mechanism without preliminary formation of N-protonated azolium salts
Belen’kii, L. I., Subbotin, A. N., Chuvylkin, N. D.
Published in Russian chemical bulletin (01.11.2015)
Published in Russian chemical bulletin (01.11.2015)
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Comparison of the capacity of nitrogen, oxygen, sulfur, and selenium atoms to exist in onium states. quantum-chemical investigation of isomeric model systems with two heteroatoms
Belen'kii, L. I, Nesterov, I. D, Chuvylkin, N. D
Published in Chemistry of heterocyclic compounds (New York, N.Y. 1965) (01.12.2008)
Published in Chemistry of heterocyclic compounds (New York, N.Y. 1965) (01.12.2008)
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Quantum chemical studies of azoles 3. Thermodynamic stabilities of neutral molecules and intermediates formed in electrophilic substitution of azoles containing three or four heteroatoms
Belen´kii, L. I., Mamarakhmonov, M. Kh, Subbotin, A. N., Chuvylkin, N. D.
Published in Russian chemical bulletin (01.05.2015)
Published in Russian chemical bulletin (01.05.2015)
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Quantum chemical studies of azoles 10. Transition states in the routes of electrophilic substitution in 1H-tetrazole via the elimination—addition mechanism without preliminary formation of N-protonated azolium salts
Chuvylkin, N. D., Subbotin, A. N., Belen´kii, L. I.
Published in Russian chemical bulletin (01.05.2017)
Published in Russian chemical bulletin (01.05.2017)
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Quantum chemical study of ferrocene derivatives 2. Arylation reactions with aminophenols
Mamarakhmonov, M. Kh, Belen´kii, L. I., Chuvylkin, N. D., Askarov, I. R.
Published in Russian chemical bulletin (01.04.2017)
Published in Russian chemical bulletin (01.04.2017)
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